CHEBI:2290 - 7α-hydroxy-5β-cholestan-3-one

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ChEBI Name 7α-hydroxy-5β-cholestan-3-one
ChEBI ID CHEBI:2290
ChEBI ASCII Name 7alpha-hydroxy-5beta-cholestan-3-one
Definition A 3-oxo steroid that is 5β-cholestan-3-one bearing an additional hydroxy substituent at position 7α .
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H46O2
Net Charge 0
Average Mass 402.65294
Monoisotopic Mass 402.350
InChI InChI=1S/C27H46O2/c1-17(2)7-6-8-18(3)21-9-10-22-25-23(12-14-27(21,22)5)26(4)13-11-20(28)15-19(26)16-24(25)29/h17-19,21-25,29H,6-16H2,1-5H3/t18-,19+,21-,22+,23+,24-,25+,26+,27-/m1/s1
InChIKey HWOOALPDOJHOPO-YREUSXKVSA-N
SMILES [H][C@]12C[C@@H](O)[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@@]34[H])[C@H](C)CCCC(C)C)[C@@]1(C)CCC(=O)C2
Metabolite of Species Details
Mus musculus (NCBI:10090) Source: BioModels - MODEL1507180067 See: PubMed
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 7α-hydroxy-5β-cholestan-3-one (CHEBI:2290) has parent hydride 5β-cholestane (CHEBI:35517)
7α-hydroxy-5β-cholestan-3-one (CHEBI:2290) has role human metabolite (CHEBI:77746)
7α-hydroxy-5β-cholestan-3-one (CHEBI:2290) has role mouse metabolite (CHEBI:75771)
7α-hydroxy-5β-cholestan-3-one (CHEBI:2290) is a 3-oxo steroid (CHEBI:47788)
7α-hydroxy-5β-cholestan-3-one (CHEBI:2290) is a 7α-hydroxy steroid (CHEBI:36843)
IUPAC Name
7α-hydroxy-5β-cholestan-3-one
Synonyms Sources
5β-cholestan-7α-ol-3-one ChEBI
5beta-Cholestan-7alpha-ol-3-one KEGG COMPOUND
7α-hydroxy-5β-cholestan-3-one UniProt
7alpha-Hydroxy-5beta-cholestan-3-one KEGG COMPOUND
Database Links Databases
C05451 KEGG COMPOUND
CPD-10548 MetaCyc
HMDB06892 HMDB
LMST04030112 LIPID MAPS
View more database links
Registry Numbers Types Sources
2300476 Beilstein Registry Number Beilstein
3159830 Reaxys Registry Number Reaxys
3159830 Beilstein Registry Number Beilstein
Last Modified
27 September 2016