7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one (BioCAD00000005489)

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Metabolite Card

Formula: C27H46O3 (418.3447)
SMILES: C1[C@]2(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@@]([H])([C@]([H])(C)CCCC(C)C)CC[C@@]4([H])[C@]3([H])[C@H](O)C[C@]2([H])CC(=O)C1

Synonyms [en]

7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one; 5beta-Cholesten-7alpha,12alpha-diol-3-one; 5beta-cholestane-7alpha,12alpha-diol-3-one; UNII-JXG7DN7KC6; JXG7DN7KC6; (5beta

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one. 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: BioCAD00000005489). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

7alpha,12alpha-Dihydroxy-5beta-cholestan-3-one

Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 547-97-7
  • PubChem: 5284271
  • ChEBI: ChEBI:2288
  • HMDB: HMDB0006887
  • HMDB: HMDB06886
  • LipidMaps: LMST04030113
  • KEGG: C05453
  • BioCyc: CPD-10503
  • RefMet: RM0126121
  • Metlin: METLIN_43117
  • Coconut NaturalProduct: CNP0347053.1
  • Coconut NaturalProduct: CNP0347053.4

Class / Ontology

Metabolic Network
ID EC Number Name
KEGG:R04823 1.3.1.3 7alpha,12alpha-dihydroxy-5beta-cholestan-3-one:NADP+ delta4-oxidoreductase
KEGG:R04824 1.1.1.50 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestane:NAD+ oxidoreductase (B-specific)
KEGG:R04825 1.1.1.50 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestane:NADP+ oxidoreductase (B-specific)
Rhea:RHEA:46633 7α,12α-dihydroxycholest-4-en-3-one + NADPH + H+ => 7α,12α-dihydroxy-5β-cholestan-3-one + NADP+
Rhea:RHEA:46634 7α,12α-dihydroxy-5β-cholestan-3-one + NADP+ => 7α,12α-dihydroxycholest-4-en-3-one + NADPH + H+
Rhea:RHEA:46635 7α,12α-dihydroxycholest-4-en-3-one + NADPH + H+ <=> 7α,12α-dihydroxy-5β-cholestan-3-one + NADP+
BioCyc:RXN-9794 1.3.1.3 CPD-7237 + NADPH + PROTON --> CPD-10503 + NADP
BioCyc:RXN-9796 1.1.1.213 5β-cholestane-3α,7α,12α-triol 3-dehydrogenase
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Organism Source

Taxonomy Source

Pathway Synthetic

pathway id name
BioCyc:MOUSE_PWY-6061 bile acid biosynthesis, neutral pathway
Reactome:R-BTA-1430728 Metabolism
Reactome:R-BTA-556833 Metabolism of lipids
Reactome:R-BTA-194068 Bile acid and bile salt metabolism
Reactome:R-CEL-194068 Bile acid and bile salt metabolism
Reactome:R-CFA-1430728 Metabolism
Reactome:R-CFA-556833 Metabolism of lipids
Reactome:R-CFA-194068 Bile acid and bile salt metabolism
Reactome:R-DDI-192105 Synthesis of bile acids and bile salts
Reactome:R-DME-194068 Bile acid and bile salt metabolism
Reactome:R-GGA-194068 Bile acid and bile salt metabolism
Reactome:R-HSA-194068 Bile acid and bile salt metabolism
Reactome:R-MMU-1430728 Metabolism
Reactome:R-MMU-556833 Metabolism of lipids
Reactome:R-MMU-8957322 Metabolism of steroids
Reactome:R-RNO-193368 Synthesis of bile acids and bile salts via 7alpha-hydroxycholesterol
Reactome:R-SCE-8957322 Metabolism of steroids
Reactome:R-SCE-194068 Bile acid and bile salt metabolism
Reactome:R-SPO-1430728 Metabolism
Reactome:R-SSC-193368 Synthesis of bile acids and bile salts via 7alpha-hydroxycholesterol
View All Pathways