6-Deoxocastasterone (BioCAD00000005154)

plant natural products microbial natural products

Metabolite Card

Formula: C28H50O4 (450.3709)
SMILES: [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@@]4([H])C[C@H](O)[C@H](O)C[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)C(C)C

Synonyms [en]

6-Deoxocastasterone; (22R,23R)-5alpha-campestane-2alpha,3alpha,22,23-tetraol; deoxocastasterone; campestan-2alpha,3alpha,22R,23R-tetrol; 169869-41-4; 4-dihydroxy-5

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

6-Deoxocastasterone. 数据之源，洞见之始. SMRUCC genomics institute, a synthetic life researcher from China. https://biocad_registry.innovation.ac.cn/s/(-)-arctiin (retrieved 2026-01-03) (CAD Registry RN: BioCAD00000005154). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

6-Deoxocastasterone belongs to the class of organic compounds known as tetrahydroxy bile acids, alcohols, and derivatives. These are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. Thus, 6-deoxocastasterone is considered to be a sterol lipid molecule. 6-Deoxocastasterone is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. 6-Deoxocastasterone is found in common bean and has been isolated from Phaseolus vulgaris (kidney bean).

Extracellular
Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 169869-41-4
  • CAS Registry Number: 87833-54-3
  • PubChem: 13870433
  • ChEBI: ChEBI:20712
  • HMDB: HMDB0033984
  • LipidMaps: LMST01030127
  • KEGG: C15802
  • BioCyc: CPD-723
  • NCBI MeSH: 6-deoxocastasterone
  • RefMet: RM0126029
  • Metlin: METLIN_64143
  • Coconut NaturalProduct: CNP0226277.1
  • Coconut NaturalProduct: CNP0226277.2
  • Coconut NaturalProduct: CNP0226277.6
  • Coconut NaturalProduct: CNP0360624.1

Class / Ontology

Metabolic Network
ID EC Number Name
KEGG:R07450 1.14.14.179 6-deoxocastasterone,NADPH---hemoprotein reductase:oxygen oxidoreductase (6alpha-hydroxylating)
KEGG:R07474 1.14.-.- 6-deoxotyphasterol,NADPH:oxygen oxidoreductase (2alpha-hydroxylating)
KEGG:R10669 1.14.14.179 6-deoxocastasterone,NADPH---hemoprotein reductase:oxygen oxidoreductase (castasterone-forming)
KEGG:R10682 1.14.-.- 6-deoxocastasterone,NADPH---hemoprotein reductase:oxygen oxidoreductase (brassinolide-forming)
Rhea:RHEA:69876 6-deoxocastasterone + reduced [NADPH—hemoprotein reductase] + O2 => 6α-hydroxycastasterone + oxidized [NADPH—hemoprotein reductase] + H2O + H+
Rhea:RHEA:69877 6α-hydroxycastasterone + oxidized [NADPH—hemoprotein reductase] + H2O + H+ => 6-deoxocastasterone + reduced [NADPH—hemoprotein reductase] + O2
Rhea:RHEA:69878 6-deoxocastasterone + reduced [NADPH—hemoprotein reductase] + O2 <=> 6α-hydroxycastasterone + oxidized [NADPH—hemoprotein reductase] + H2O + H+
Rhea:RHEA:70032 1.14.14.179 6-deoxocastasterone + 2 reduced [NADPH—hemoprotein reductase] + 2 O2 => castasterone + 2 oxidized [NADPH—hemoprotein reductase] + 3 H2O + 2 H+
Rhea:RHEA:70033 1.14.14.179 castasterone + 2 oxidized [NADPH—hemoprotein reductase] + 3 H2O + 2 H+ => 6-deoxocastasterone + 2 reduced [NADPH—hemoprotein reductase] + 2 O2
Rhea:RHEA:70034 1.14.14.179 6-deoxocastasterone + 2 reduced [NADPH—hemoprotein reductase] + 2 O2 <=> castasterone + 2 oxidized [NADPH—hemoprotein reductase] + 3 H2O + 2 H+
BioCyc:RXN-778 1.14.14.- CPD-723 + OXYGEN-MOLECULE + Red-NADPH-Hemoprotein-Reductases --> CPD-724 + WATER + Ox-NADPH-Hemoprotein-Reductases
BioCyc:RXN-777 1.14.14.- CPD-720 + OXYGEN-MOLECULE + Red-NADPH-Hemoprotein-Reductases --> CPD-723 + WATER + Ox-NADPH-Hemoprotein-Reductases
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Organism Source

Taxonomy Source

  1. Adenocarpus commutatus [ncbi taxid: 692158]
  2. Alseodaphne semecarpifolia [ncbi taxid: 128588]
  3. Corynespora cassiicola [ncbi taxid: 59586]
  4. Cupressus arizonica [ncbi taxid: ]
  5. Daphnandra micrantha [ncbi taxid: 74882]
  6. Delphinium tatsienense [ncbi taxid: 1045312]
  7. Fagus menziesii [ncbi taxid: ]
  8. Ficus fistulosa [ncbi taxid: 309341]
  9. Ganoderma applanatum [ncbi taxid: 29884]
  10. Iphiona scabra [ncbi taxid: 211591]
  11. Lagenaria siceraria [ncbi taxid: 3668]
  12. Osteospermum thodei [ncbi taxid: ]
  13. Penicillium nalgiovensis [ncbi taxid: ]
  14. Phaseolus vulgaris [ncbi taxid: 3885]
  15. Polygonum maritimum [ncbi taxid: 512629]
  16. Rheum undulatum [ncbi taxid: 137227]
  17. Sargassum parvivesiculosum [ncbi taxid: ]
  18. Scrophularia deserti [ncbi taxid: 1042505]
  19. Streptomyces scabiei [ncbi taxid: 1930]
  20. Tagetes minuta [ncbi taxid: 169607]
  21. Viguiera lanceolata [ncbi taxid: 1048887]
  22. Arabidopsis thaliana [ncbi taxid: 3702]
  23. Castanea crenata [ncbi taxid: 103480]
  24. Dolichos lablab [ncbi taxid: ]
  25. Phaseolus vulgaris [ncbi taxid: 3885]

Pathway Synthetic

pathway id name
BioCyc:META_PWY-6544 superpathway of C28 brassinosteroid biosynthesis
BioCyc:META_PWY-699 brassinosteroid biosynthesis I
BioCyc:ARA_PWY-699 brassinosteroid biosynthesis I
PlantCyc:SPENNELLII_PWY-6544 superpathway of C28 brassinosteroid biosynthesis
PlantCyc:SPIRODELA_PWY-2582 brassinolide biosynthesis II
PlantCyc:SPIRODELA_PWY-699 brassinolide biosynthesis I
PlantCyc:AHALLERI_PWY-2582 brassinolide biosynthesis II
PlantCyc:AHALLERI_PWY-699 brassinolide biosynthesis I
PlantCyc:AMBORELLA_PWY-699 brassinolide biosynthesis I
PlantCyc:TOMATO_PWY-699 brassinolide biosynthesis I
PlantCyc:TPARVULA_PWY-699 brassinolide biosynthesis I
PlantCyc:BANANA_PWY-699 brassinolide biosynthesis I
PlantCyc:WHEATA_PWY-2582 brassinolide biosynthesis II
PlantCyc:BARLEY_PWY-699 brassinosteroid biosynthesis I
PlantCyc:WHEATD_PWY-2582 brassinolide biosynthesis II
PlantCyc:BARLEY_PWY-6544 superpathway of C28 brassinosteroid biosynthesis
PlantCyc:BOLERACEA_CAPITATA_PWY-2582 brassinolide biosynthesis II
PlantCyc:BOLERACEA_CAPITATA_PWY-699 brassinolide biosynthesis I
PlantCyc:BRACHYPODIUM_PWY-6544 superpathway of C28 brassinosteroid biosynthesis
PlantCyc:BRAPA_FPSC_PWY-699 brassinolide biosynthesis I
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