Rubus idaeus

ncbi_taxid: 32247 - Rubus idaeus(species); all_childs: 59501, 59503, 2697234, 2953672, 2982852, 3058169

taxonomy name: Rubus idaeus (species)
ancestor: Rubus (genus)

Child Taxonomy

taxonomy name rank note
Rubus idaeus subsp. idaeus subspecies ncbi_taxid: 59501 - Rubus idaeus subsp. idaeus(subspecies); all_childs:
Rubus idaeus subsp. strigosus subspecies ncbi_taxid: 59503 - Rubus idaeus subsp. strigosus(subspecies); all_childs:
Rubus idaeus var. aculeatissimus varietas ncbi_taxid: 2697234 - Rubus idaeus var. aculeatissimus(varietas); all_childs:
Rubus idaeus subsp. nipponicus subspecies ncbi_taxid: 2953672 - Rubus idaeus subsp. nipponicus(subspecies); all_childs: 2953673
Rubus idaeus f. concolor forma ncbi_taxid: 2982852 - Rubus idaeus f. concolor(forma); all_childs:
Rubus idaeus var. borealisinensis varietas ncbi_taxid: 3058169 - Rubus idaeus var. borealisinensis(varietas); all_childs:

Enzyme Proteins

protein id name ec_number function

Metabolites

LCMS Annotations
Literature Annotations
Metabolite Database Reference Structure
11-cis-Retinol

Formula: C20H30O
Exact Mass: 286.2297
Source ID: CNP0254958.0
  • CAS Registry: 22737-96-8
  • KEGG: C00899
  • LipidMAPS: LMPR01090005
  • BioCYC:
beta-Carotene

Formula: C40H56
Exact Mass: 536.4382
Source ID: CNP0233748.0
  • CAS Registry: 7235-40-7
  • KEGG: C02094
  • LipidMAPS: LMPR01070001
  • BioCYC: CPD1F-129
D-Glucose

Formula: C6H12O6
Exact Mass: 180.0634
Source ID: CNP0210547.4
  • CAS Registry: 50-99-7
  • KEGG: C00031
  • LipidMAPS:
  • BioCYC: D-Glucose
Rutin

Formula: C27H30O16
Exact Mass: 610.1534
Source ID: CNP0268715.1
  • CAS Registry: 153-18-4
  • KEGG: C05625
  • LipidMAPS: LMPK12112098
  • BioCYC: RUTIN
Cyanidin 3-O-rutinoside

Formula: C27H31O15
Exact Mass: 595.1663
Source ID: CNP0486998.1
  • CAS Registry: 28338-59-2
  • KEGG: C08620
  • LipidMAPS: LMPK12010452
  • BioCYC:
Ascorbic acid

Formula: C6H8O6
Exact Mass: 176.0321
Source ID: CNP0367758.1
  • CAS Registry: 50-81-7
  • KEGG: C01041
  • LipidMAPS:
  • BioCYC:
4-Hydroxybenzaldehyde

Formula: C7H6O2
Exact Mass: 122.0368
Source ID: CNP0230702.0
  • CAS Registry: 123-08-0
  • KEGG: C00633
  • LipidMAPS:
  • BioCYC: 4-HYDROXYBENZALDEHYDE
beta-Sitosterol

Formula: C29H50O
Exact Mass: 414.3861
Source ID: CNP0236620.1
  • CAS Registry: 83-46-5
  • KEGG: C01753
  • LipidMAPS: LMST01040129
  • BioCYC: CPD-4143
Kaempferol

Formula: C15H10O6
Exact Mass: 286.0477
Source ID: CNP0292269.0
  • CAS Registry: 520-18-3
  • KEGG: C05903
  • LipidMAPS: LMPK12110003
  • BioCYC: CPD1F-90
Quercetin

Formula: C15H10O7
Exact Mass: 302.0427
Source ID: CNP0103504.0
  • CAS Registry: 117-39-5
  • KEGG: C00389
  • LipidMAPS: LMPK12110004
  • BioCYC: CPD-520
Ferulate

Formula: C10H10O4
Exact Mass: 194.0579
Source ID: CNP0304940.0
  • CAS Registry: 537-98-4
  • KEGG: C01494
  • LipidMAPS:
  • BioCYC: FERULIC-ACID
Hyperin

Formula: C21H20O12
Exact Mass: 464.0955
Source ID: CNP0180599.1
  • CAS Registry: 482-36-0
  • KEGG: C10073
  • LipidMAPS: LMPK12112041
  • BioCYC:
Quercitrin

Formula: C21H20O11
Exact Mass: 448.1006
Source ID: CNP0171505.1
  • CAS Registry: 522-12-3
  • KEGG: C01750
  • LipidMAPS: LMPK12112171
  • BioCYC: QUERCITRIN
Isoquercitrin

Formula: C21H20O12
Exact Mass: 464.0955
Source ID: CNP0180599.2
  • CAS Registry: 21637-25-2
  • KEGG: C05623
  • LipidMAPS: LMPK12112086
  • BioCYC:
Gallate

Formula: C7H6O5
Exact Mass: 170.0215
Source ID: CNP0133244.0
  • CAS Registry: 149-91-7
  • KEGG: C01424
  • LipidMAPS:
  • BioCYC: CPD-183
Caffeate

Formula: C9H8O4
Exact Mass: 180.0423
Source ID: CNP0186784.0
  • CAS Registry: 331-39-5
  • KEGG: C01481
  • LipidMAPS:
  • BioCYC: CPD-8098
4-Coumarate

Formula: C9H8O3
Exact Mass: 164.0473
Source ID: CNP0255341.0
  • CAS Registry: 7400-08-0
  • KEGG: C00811
  • LipidMAPS:
  • BioCYC:
(-)-Epicatechin

Formula: C15H14O6
Exact Mass: 290.079
Source ID: CNP0293352.2
  • CAS Registry: 490-46-0
  • KEGG: C09727
  • LipidMAPS: LMPK12020003
  • BioCYC: CPD-7630
Esculetin

Formula: C9H6O4
Exact Mass: 178.0266
Source ID: CNP0386988.0
  • CAS Registry: 305-01-1
  • KEGG: C09263
  • LipidMAPS:
  • BioCYC: CPD-8097
4-Hydroxybenzoate

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0253685.0
  • CAS Registry: 99-96-7
  • KEGG: C00156
  • LipidMAPS:
  • BioCYC:
trans-Cinnamate

Formula: C9H8O2
Exact Mass: 148.0524
Source ID: CNP0390407.0
  • CAS Registry: 140-10-3
  • KEGG: C00423
  • LipidMAPS:
  • BioCYC:
Salicylate

Formula: C7H6O3
Exact Mass: 138.0317
Source ID: CNP0230203.0
  • CAS Registry: 69-72-7
  • KEGG: C00805
  • LipidMAPS:
  • BioCYC: CPD-110
Vanillate

Formula: C8H8O4
Exact Mass: 168.0423
Source ID: CNP0122021.0
  • CAS Registry: 121-34-6
  • KEGG: C06672
  • LipidMAPS:
  • BioCYC:
4-Hydroxy-3-methoxy-benzaldehyde

Formula: C8H8O3
Exact Mass: 152.0473
Source ID: CNP0270199.0
  • CAS Registry: 121-33-5
  • KEGG: C00755
  • LipidMAPS:
  • BioCYC: VANILLIN
(+)-Catechin

Formula: C15H14O6
Exact Mass: 290.079
Source ID: CNP0293352.3
  • CAS Registry: 154-23-4
  • KEGG: C06562
  • LipidMAPS: LMPK12020001
  • BioCYC: CPD-1961
L-Tryptophan

Formula: C11H12N2O2
Exact Mass: 204.0899
Source ID: CNP0167976.1
  • CAS Registry: 73-22-3
  • KEGG: C00078
  • LipidMAPS:
  • BioCYC: TRP
Cyanidin

Formula: C15H11O6
Exact Mass: 287.0556
Source ID: CNP0492502.0
  • CAS Registry: 528-58-5
  • KEGG: C05905
  • LipidMAPS: LMPK12010002
  • BioCYC: CPD-591
alpha-Tocopherol

Formula: C29H50O2
Exact Mass: 430.3811
Source ID: CNP0338526.1
  • CAS Registry: 59-02-9
  • KEGG: C02477
  • LipidMAPS: LMPR02020001
  • BioCYC: ALPHA-TOCOPHEROL
Choline

Formula: C5H14NO
Exact Mass: 104.1075
Source ID: CNP0161849.0
  • CAS Registry: 62-49-7
  • KEGG: C00114
  • LipidMAPS:
  • BioCYC: CHOLINE
Quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside

Formula: C27H30O17
Exact Mass: 626.1483
Source ID: CNP0235373.1
  • CAS Registry: 18609-17-1
  • KEGG: C12667
  • LipidMAPS:
  • BioCYC: CPD-14849
Thiamine

Formula: C12H17N4OS
Exact Mass: 265.1123
Source ID: CNP0538996.0
  • CAS Registry: 70-16-6
  • KEGG: C00378
  • LipidMAPS:
  • BioCYC: THIAMINE
L-Arginine

Formula: C6H14N4O2
Exact Mass: 174.1117
Source ID: CNP0257247.1
  • CAS Registry: 74-79-3
  • KEGG: C00062
  • LipidMAPS:
  • BioCYC: ARG
Ellagic acid

Formula: C14H6O8
Exact Mass: 302.0063
Source ID: CNP0224900.0
  • CAS Registry: 476-66-4
  • KEGG: C10788
  • LipidMAPS:
  • BioCYC: CPD-17769
Dihydroxybenzoic acid

Formula: C7H6O4
Exact Mass: 154.0266
Source ID: CNP0348948.0
  • CAS Registry: 303-38-8
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pyridoxine

Formula: C8H11NO3
Exact Mass: 169.0739
Source ID: CNP0297581.0
  • CAS Registry: 65-23-6
  • KEGG: C00314
  • LipidMAPS:
  • BioCYC: PYRIDOXINE
Kaempferol 3-O-glucoside

Formula: C21H20O11
Exact Mass: 448.1006
Source ID: CNP0187953.2
  • CAS Registry: 480-10-4
  • KEGG: C12249
  • LipidMAPS: LMPK12111725
  • BioCYC: CPD1F-453
Dopamine

Formula: C8H11NO2
Exact Mass: 153.079
Source ID: CNP0254743.0
  • CAS Registry: 51-61-6
  • KEGG: C03758
  • LipidMAPS:
  • BioCYC: DOPAMINE
L-Citrulline

Formula: C6H13N3O3
Exact Mass: 175.0957
Source ID: CNP0209633.1
  • CAS Registry: 372-75-8
  • KEGG: C00327
  • LipidMAPS:
  • BioCYC: L-CITRULLINE
Alanine

Formula: C3H7NO2
Exact Mass: 89.0477
Source ID: CNP0313085.1
  • CAS Registry: 302-72-7
  • KEGG: C01401
  • LipidMAPS:
  • BioCYC: L-ALPHA-ALANINE
Phenethylamine

Formula: C8H11N
Exact Mass: 121.0891
Source ID: CNP0141127.0
  • CAS Registry: 64-04-0
  • KEGG: C05332
  • LipidMAPS:
  • BioCYC:
Shikimate

Formula: C7H10O5
Exact Mass: 174.0528
Source ID: CNP0162867.1
  • CAS Registry: 138-59-0
  • KEGG: C00493
  • LipidMAPS:
  • BioCYC:
Neochlorogenic acid

Formula: C16H18O9
Exact Mass: 354.0951
Source ID: CNP0148557.2
  • CAS Registry: 906-33-2
  • KEGG: C17147
  • LipidMAPS:
  • BioCYC:
Asparagine

Formula: C4H8N2O3
Exact Mass: 132.0535
Source ID: CNP0267849.1
  • CAS Registry: 3130-87-8
  • KEGG: C16438
  • LipidMAPS:
  • BioCYC:
Isoleucine

Formula: C6H13NO2
Exact Mass: 131.0946
Source ID: CNP0337843.1
  • CAS Registry: 443-79-8
  • KEGG: C16434
  • LipidMAPS:
  • BioCYC:
Hexacosan-1-ol

Formula: C26H54O
Exact Mass: 382.4174
Source ID: CNP0154771.0
  • CAS Registry: 506-52-5
  • KEGG: C08381
  • LipidMAPS: LMFA05000002
  • BioCYC: CPD-7871
alpha-Carotene

Formula: C40H56
Exact Mass: 536.4382
Source ID: CNP0220836.1
  • CAS Registry: 7488-99-5
  • KEGG: C05433
  • LipidMAPS: LMPR01070258
  • BioCYC: CPD1F-118
4-hydroxy-7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridin-2-one

Formula: C17H20N4O6
Exact Mass: 376.1383
Source ID: CNP0561800.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Threonine

Formula: C4H9NO3
Exact Mass: 119.0582
Source ID: CNP0361197.1
  • CAS Registry: 72-19-5
  • KEGG: C00188
  • LipidMAPS:
  • BioCYC: THR
Triacontan-1-ol

Formula: C30H62O
Exact Mass: 438.48
Source ID: CNP0150741.0
  • CAS Registry: 593-50-0
  • KEGG: C08392
  • LipidMAPS: LMFA05000006
  • BioCYC: CPD-7877
L-Lysine

Formula: C6H14N2O2
Exact Mass: 146.1055
Source ID: CNP0204700.1
  • CAS Registry: 56-87-1
  • KEGG: C00047
  • LipidMAPS:
  • BioCYC: LYS
Nicotinate

Formula: C6H5NO2
Exact Mass: 123.032
Source ID: CNP0319168.0
  • CAS Registry: 59-67-6
  • KEGG: C00253
  • LipidMAPS:
  • BioCYC: NIACINE
Lutein

Formula: C40H56O2
Exact Mass: 568.428
Source ID: CNP0216202.1
  • CAS Registry: 127-40-2
  • KEGG: C08601
  • LipidMAPS: LMPR01070274
  • BioCYC: CPD1F-119
Glycine

Formula: C2H5NO2
Exact Mass: 75.032
Source ID: CNP0563879.0
  • CAS Registry: 56-40-6
  • KEGG: C00037
  • LipidMAPS:
  • BioCYC: GLY
Hexacosyl trans-ferulate

Formula: C36H62O4
Exact Mass: 558.4648
Source ID: CNP0379893.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Quercetin 3-O-glucuronide

Formula: C21H18O13
Exact Mass: 478.0747
Source ID: CNP0230774.1
  • CAS Registry: 22688-79-5
  • KEGG:
  • LipidMAPS: LMPK12112173
  • BioCYC:
Procyanidin B2

Formula: C30H26O12
Exact Mass: 578.1424
Source ID: CNP0192174.3
  • CAS Registry: 29106-49-8
  • KEGG: C17639
  • LipidMAPS: LMPK12030002
  • BioCYC: CPD-1981
Imperatorin

Formula: C16H14O4
Exact Mass: 270.0892
Source ID: CNP0270767.0
  • CAS Registry: 482-44-0
  • KEGG: C09269
  • LipidMAPS:
  • BioCYC: CPD-20603
Dihydrokaempferol

Formula: C15H12O6
Exact Mass: 288.0634
Source ID: CNP0230258.2
  • CAS Registry: 480-20-6
  • KEGG: C00974
  • LipidMAPS: LMPK12140720
  • BioCYC: DIHYDROKAEMPFEROL-CMPD
Procyanidin B4

Formula: C30H26O12
Exact Mass: 578.1424
Source ID: CNP0192174.4
  • CAS Registry: 29106-51-2
  • KEGG: C10238
  • LipidMAPS: LMPK12030004
  • BioCYC:
Arjugenin

Formula: C30H48O6
Exact Mass: 504.3451
Source ID: CNP0252493.2
  • CAS Registry: 58880-25-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Glutamine

Formula: C5H10N2O3
Exact Mass: 146.0691
Source ID: CNP0361973.1
  • CAS Registry: 6899-04-3
  • KEGG: C00303
  • LipidMAPS:
  • BioCYC:
Pantothenate

Formula: C9H17NO5
Exact Mass: 219.1107
Source ID: CNP0153142.1
  • CAS Registry: 79-83-4
  • KEGG: C00864
  • LipidMAPS: LMFA08020419
  • BioCYC: PANTOTHENATE
Pelargonidin

Formula: C15H11O5
Exact Mass: 271.0606
Source ID: CNP0525213.0
  • CAS Registry: 134-04-3
  • KEGG: C05904
  • LipidMAPS: LMPK12010003
  • BioCYC:
Kaempferol 3-glucuronide

Formula: C21H18O12
Exact Mass: 462.0798
Source ID: CNP0263661.1
  • CAS Registry: 22688-78-4
  • KEGG:
  • LipidMAPS: LMPK12111843
  • BioCYC:


Formula: C30H48O4
Exact Mass: 472.3552
Source ID: CNP0227468.5
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C27H30O16
Exact Mass: 610.1534
Source ID: CNP0477936.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C30H48O5
Exact Mass: 488.3502
Source ID: CNP0127153.5
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-(4-Hydroxyphenyl)-2-butanone

Formula: C10H12O2
Exact Mass: 164.0837
Source ID: CNP0218694.0
  • CAS Registry: 5471-51-2
  • KEGG:
  • LipidMAPS:
  • BioCYC: CPD-8647
NSC715079

Formula: C30H48O5
Exact Mass: 488.3502
Source ID: CNP0076350.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Hyperin

Formula: C21H20O12
Exact Mass: 464.0955
Source ID: CNP0602823.0
  • CAS Registry: 482-36-0
  • KEGG: C10073
  • LipidMAPS: LMPK12112041
  • BioCYC:
Tribuloside

Formula: C30H26O13
Exact Mass: 594.1373
Source ID: CNP0167834.3
  • CAS Registry: 22153-44-2
  • KEGG: C17140
  • LipidMAPS: LMPK12111791
  • BioCYC:
Cyanidin 3-O-glucoside

Formula: C21H21O11
Exact Mass: 449.1084
Source ID: CNP0583867.1
  • CAS Registry: 7084-24-4
  • KEGG: C08604
  • LipidMAPS: LMPK12010110
  • BioCYC:
pentadecanethioic O-acid

Formula: C15H30OS
Exact Mass: 258.2017
Source ID: CNP0085720.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Delphinidin 3-O-glucoside

Formula: C21H21O12
Exact Mass: 465.1033
Source ID: CNP0586863.2
  • CAS Registry: 6906-38-3
  • KEGG: C12138
  • LipidMAPS: LMPK12010278
  • BioCYC:


Formula: C30H48O4
Exact Mass: 472.3552
Source ID: CNP0141707.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
FSL0569

Formula: C19H19N7O6
Exact Mass: 441.1397
Source ID: CNP0528342.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Crataegolic acid

Formula: C30H48O4
Exact Mass: 472.3552
Source ID: CNP0227468.7
  • CAS Registry: 4373-41-5
  • KEGG: C16939
  • LipidMAPS: LMPR0106180014
  • BioCYC:
Betulonic acid

Formula: C30H46O3
Exact Mass: 454.3447
Source ID: CNP0115283.2
  • CAS Registry: 4481-62-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Phlorizin

Formula: C21H24O10
Exact Mass: 436.1369
Source ID: CNP0290030.2
  • CAS Registry: 60-81-1
  • KEGG: C01604
  • LipidMAPS: LMPK12120517
  • BioCYC: CPD-12447
kaempferol-3-rutinoside

Formula: C27H30O15
Exact Mass: 594.1585
Source ID: CNP0222584.6
  • CAS Registry: 17650-84-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-Hydroxy-3,6,7,8-tetramethoxyflavone

Formula: C19H18O7
Exact Mass: 358.1052
Source ID: CNP0167350.0
  • CAS Registry: 15249-62-4
  • KEGG:
  • LipidMAPS: LMPK12113296
  • BioCYC:
1-hydroxyisoquinoline-4-carboxylic acid

Formula: C10H7NO3
Exact Mass: 189.0426
Source ID: CNP0399211.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cyanidin 3-O-glucoside

Formula: C21H21O11
Exact Mass: 449.1084
Source ID: CNP0583867.3
  • CAS Registry: 7084-24-4
  • KEGG: C08604
  • LipidMAPS: LMPK12010110
  • BioCYC:
Putrescine

Formula: C4H12N2
Exact Mass: 88.1
Source ID: CNP0116270.0
  • CAS Registry: 110-60-1
  • KEGG: C00134
  • LipidMAPS:
  • BioCYC: PUTRESCINE
Fupenzic acid

Formula: C30H44O5
Exact Mass: 484.3189
Source ID: CNP0161509.1
  • CAS Registry: 119725-20-1
  • KEGG:
  • LipidMAPS:
  • BioCYC:
5-[5,7-dihydroxy-3-[(2~{S},3~{R},4~{S},5~{S},6~{R})-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-chromenylium-2-yl]-2-hydroxy-phenolate;hydrochloride

Formula: C21H21ClO11
Exact Mass: 484.0772
Source ID: CNP0568612.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Corosolic acid

Formula: C30H48O4
Exact Mass: 472.3552
Source ID: CNP0215187.5
  • CAS Registry: 4547-24-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
methyl 2-(2,3-dihydroxyindol-3-yl)acetate

Formula: C11H11NO4
Exact Mass: 221.0688
Source ID: CNP0534786.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Sanguiin H6

Formula: C82H54O52
Exact Mass: 1870.1581
Source ID: CNP0188888.1
  • CAS Registry: 82978-00-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pelargonidin 3-O-sophoroside

Formula: C27H31O15
Exact Mass: 595.1663
Source ID: CNP0591929.1
  • CAS Registry: 34365-81-6
  • KEGG: C16305
  • LipidMAPS:
  • BioCYC: CPD-7843
Pelargonidin 3-O-glucoside

Formula: C21H21O10
Exact Mass: 433.1135
Source ID: CNP0525096.1
  • CAS Registry: 18466-51-8
  • KEGG: C12137
  • LipidMAPS: LMPK12010016
  • BioCYC: PELARGONIDIN-3-GLUCOSIDE-CMPD
Stigmast-5-en-3-ol, oleate

Formula: C47H82O2
Exact Mass: 678.6314
Source ID: CNP0148171.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
30-Hydroxy-11-oxo-beta-amyrin

Formula: C30H48O3
Exact Mass: 456.3603
Source ID: CNP0326904.1
  • CAS Registry: 14226-18-7
  • KEGG: C20510
  • LipidMAPS:
  • BioCYC: CPD-13670
Adipate

Formula: C6H10O4
Exact Mass: 146.0579
Source ID: CNP0296801.0
  • CAS Registry: 124-04-9
  • KEGG: C06104
  • LipidMAPS: LMFA01170048
  • BioCYC: ADIPATE
Pelargonidin 3-O-rutinoside

Formula: C27H31O14
Exact Mass: 579.1714
Source ID: CNP0605108.1
  • CAS Registry: 33978-17-5
  • KEGG: C12644
  • LipidMAPS: LMPK12010021
  • BioCYC:
kaempferol 3-O-beta-D-allopyranoside

Formula: C21H20O11
Exact Mass: 448.1006
Source ID: CNP0187953.8
  • CAS Registry: 69292-77-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2R,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Formula: C10H13N5O4
Exact Mass: 267.0967
Source ID: CNP0216822.5
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Kaempferol-3-O-rutinoside

Formula: C27H30O15
Exact Mass: 594.1585
Source ID: CNP0222584.7
  • CAS Registry: 17650-84-9
  • KEGG: C21833
  • LipidMAPS: LMPK12111734
  • BioCYC: CPD-15072


Formula: C35H60O6
Exact Mass: 576.439
Source ID: CNP0324146.17
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C30H54O4
Exact Mass: 478.4022
Source ID: CNP0152512.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cyanidin 3-O-sophoroside

Formula: C27H31O16
Exact Mass: 611.1612
Source ID: CNP0571402.1
  • CAS Registry: 38820-68-7
  • KEGG: C16306
  • LipidMAPS:
  • BioCYC:
1-[(2R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxypyrimidin-2-one

Formula: C9H12N2O6
Exact Mass: 244.0695
Source ID: CNP0553636.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(2R,3R,4S,5R)-2-(6-hydroxy-2-imino-3H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

Formula: C10H13N5O5
Exact Mass: 283.0917
Source ID: CNP0560283.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
methyl 1-hydroxyisoquinoline-4-carboxylate

Formula: C11H9NO3
Exact Mass: 203.0582
Source ID: CNP0079758.0
  • CAS Registry: 2905-68-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Dihydrooroxylin

Formula: C16H14O5
Exact Mass: 286.0841
Source ID: CNP0229393.1
  • CAS Registry: 18956-18-8
  • KEGG:
  • LipidMAPS: LMPK12140611
  • BioCYC:
cis-4-Hydroxy-L-proline

Formula: C5H9NO3
Exact Mass: 131.0582
Source ID: CNP0368925.3
  • CAS Registry: 618-27-9
  • KEGG: C01015
  • LipidMAPS:
  • BioCYC:
Hyperin

Formula: C21H20O12
Exact Mass: 464.0955
Source ID: CNP0180599.13
  • CAS Registry: 482-36-0
  • KEGG: C10073
  • LipidMAPS: LMPK12112041
  • BioCYC:
Malvidin 3-O-glucoside

Formula: C23H25O12
Exact Mass: 493.1346
Source ID: CNP0503096.5
  • CAS Registry: 18470-06-9
  • KEGG: C12140
  • LipidMAPS: LMPK12010372
  • BioCYC:
Tiliroside

Formula: C30H26O13
Exact Mass: 594.1373
Source ID: CNP0167834.4
  • CAS Registry: 20316-62-5
  • KEGG: C17140
  • LipidMAPS: LMPK12111791
  • BioCYC: CPD-14976
(1S,4aR,6aS,6bR,10R,11R,12aR,14bS)-1,10,11-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Formula: C30H48O5
Exact Mass: 488.3502
Source ID: CNP0586910.1
  • CAS Registry: 11032-62-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Actinidic acid

Formula: C30H46O5
Exact Mass: 486.3345
Source ID: CNP0268104.1
  • CAS Registry: 341971-45-7
  • KEGG:
  • LipidMAPS: LMPR0106180010
  • BioCYC:
Histidine

Formula: C6H9N3O2
Exact Mass: 155.0695
Source ID: CNP0584490.2
  • CAS Registry: 4998-57-6
  • KEGG: C00768
  • LipidMAPS:
  • BioCYC:
19alpha-hydroxyasiatic acid-28-O-beta-D-glucopyrannoside

Formula: C36H58O11
Exact Mass: 666.3979
Source ID: CNP0183445.5
  • CAS Registry: 95262-48-9
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C32H56O5
Exact Mass: 520.4128
Source ID: CNP0305791.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
3-Epioleanolic acid

Formula: C30H48O3
Exact Mass: 456.3603
Source ID: CNP0243832.1
  • CAS Registry: 25499-90-5
  • KEGG:
  • LipidMAPS: LMPR0106150020
  • BioCYC:
Ribisin B

Formula: C14H14O5
Exact Mass: 262.0841
Source ID: CNP0124465.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Polyoxyethylene 40 monostearate

Formula: C20H40O3
Exact Mass: 328.2977
Source ID: CNP0168351.0
  • CAS Registry: 9004-99-3
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Oxo-1,2-dihydroquinoline-4-carboxylate

Formula: C10H7NO3
Exact Mass: 189.0426
Source ID: CNP0287412.0
  • CAS Registry: 15733-89-8
  • KEGG: C16715
  • LipidMAPS:
  • BioCYC:
2-Oxo-1,2-dihydroquinoline-4-carboxylate

Formula: C10H7NO3
Exact Mass: 189.0426
Source ID: CNP0484710.0
  • CAS Registry: 15733-89-8
  • KEGG: C16715
  • LipidMAPS:
  • BioCYC:
1-hydroxyisoquinoline-4-carboxylic acid

Formula: C10H7NO3
Exact Mass: 189.0426
Source ID: CNP0494734.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Cyanidin 3-sophoroside

Formula: C27H31O16
Exact Mass: 611.1612
Source ID: CNP0571402.2
  • CAS Registry: 18376-31-3
  • KEGG: C16306
  • LipidMAPS: LMPK12010115
  • BioCYC:
Cyanidin 3-sambubioside

Formula: C26H29O15
Exact Mass: 581.1506
Source ID: CNP0491541.4
  • CAS Registry: 33012-73-6
  • KEGG:
  • LipidMAPS: LMPK12010114
  • BioCYC:
Procyanidin B4

Formula: C30H26O12
Exact Mass: 578.1424
Source ID: CNP0192174.18
  • CAS Registry: 29106-51-2
  • KEGG: C10238
  • LipidMAPS: LMPK12030004
  • BioCYC:
Pelargonidin 3-(2glu glucosylrutinoside)

Formula: C33H41O19
Exact Mass: 741.2242
Source ID: CNP0579931.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one

Formula: C10H13N5O5
Exact Mass: 283.0917
Source ID: CNP0591075.3
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
methyl 1-hydroxyisoquinoline-4-carboxylate

Formula: C11H9NO3
Exact Mass: 203.0582
Source ID: CNP0502892.0
  • CAS Registry: 2905-68-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Quercetin 3-O-xylosyl-glucuronide

Formula: C26H26O17
Exact Mass: 610.117
Source ID: CNP0021885.1
  • CAS Registry: 117-39-5
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ellagic acid arabinoside

Formula: C19H14O12
Exact Mass: 434.0485
Source ID: CNP0238357.3
  • CAS Registry: 302-72-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ellagic acid acetyl-arabinoside

Formula: C21H16O13
Exact Mass: 476.0591
Source ID: CNP0104355.1
  • CAS Registry: 476-66-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Ellagic acid acetyl-xyloside

Formula: C21H16O13
Exact Mass: 476.0591
Source ID: CNP0104355.2
  • CAS Registry: 476-66-4
  • KEGG:
  • LipidMAPS:
  • BioCYC:


Formula: C123H80O78
Exact Mass: 2804.2293
Source ID: CNP0050552.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Pelargonidin 3-sophoroside

Formula: C28H33O14
Exact Mass: 593.187
Source ID: CNP0568262.1
  • CAS Registry: 54542-60-8
  • KEGG: C16305
  • LipidMAPS:
  • BioCYC:
Creatinine

Formula: C4H7N3O
Exact Mass: 113.0589
Source ID: CNP0479644.0
  • CAS Registry: 60-27-5
  • KEGG: C00791
  • LipidMAPS:
  • BioCYC: CREATININE
(2~{S})-2-amino-5-[(~{N},~{N}-dimethylcarbamimidoyl)amino]pentanoic acid

Formula: C8H18N4O2
Exact Mass: 202.143
Source ID: CNP0258830.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC: