CHEBI:36237 - cholanic acid

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ChEBI Name cholanic acid
ChEBI ID CHEBI:36237
Definition A steroid acid that consists of cholane having a carboxy group in place of the methyl group at position 24.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H40O2
Net Charge 0
Average Mass 360.57320
Monoisotopic Mass 360.30283
InChI InChI=1S/C24H40O2/c1-16(7-12-22(25)26)19-10-11-20-18-9-8-17-6-4-5-14-23(17,2)21(18)13-15-24(19,20)3/h16-21H,4-15H2,1-3H3,(H,25,26)/t16-,17?,18+,19-,20+,21+,23+,24-/m1/s1
InChIKey RPKLZQLYODPWTM-KBMWBBLPSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4CCCC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(O)=O
ChEBI Ontology
Outgoing cholanic acid (CHEBI:36237) is a cholanic acids (CHEBI:36278)
Incoming 5α-cholanic acid (CHEBI:36239) is a cholanic acid (CHEBI:36237)
5β-cholanic acid (CHEBI:36238) is a cholanic acid (CHEBI:36237)
IUPAC Name
cholan-24-oic acid
Manual Xref Database
JP2008069152 Patent
View more database links
Registry Numbers Types Sources
13246008 Reaxys Registry Number Reaxys
25312-65-6 CAS Registry Number ChemIDplus
Last Modified
29 September 2011