CHEBI:63833 - (24S)-5β-cholestane-3α,7α,24,26-tetrol

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ChEBI Name (24S)-5β-cholestane-3α,7α,24,26-tetrol
ChEBI ID CHEBI:63833
ChEBI ASCII Name (24S)-5beta-cholestane-3alpha,7alpha,24,26-tetrol
Definition 5β-Cholestane-3α,7α,24,26-tetrol with S-configuration at C-24.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C27H48O4
Net Charge 0
Average Mass 436.66760
Monoisotopic Mass 436.35526
InChI InChI=1S/C27H48O4/c1-16(5-8-23(30)17(2)15-28)20-6-7-21-25-22(10-12-27(20,21)4)26(3)11-9-19(29)13-18(26)14-24(25)31/h16-25,28-31H,5-15H2,1-4H3/t16-,17?,18+,19-,20-,21+,22+,23+,24-,25+,26+,27-/m1/s1
InChIKey KOHAQNVGTABZFS-MNABXBHASA-N
SMILES [H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CC[C@H](O)C(C)CO
Roles Classification
Biological Role(s): bile acid metabolite
Metabolites of bile acids, four-ringed steroid acids formed along the cholesterol degradation pathway.
(via 5beta-cholestane-3alpha,7alpha,24,26-tetrol )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (24S)-5β-cholestane-3α,7α,24,26-tetrol (CHEBI:63833) is a 5β-cholestane-3α,7α,24,26-tetrol (CHEBI:48731)
IUPAC Name
(24S)-5β-cholestane-3α,7α,24,26-tetrol
Synonym Source
5β-cholestan-3α,7α,24(S),27-tetrol ChEBI
Last Modified
06 February 2012