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CHEBI:181188 - Norhyodeoxycholic acid

ChEBI IDCHEBI:181188
ChEBI NameNorhyodeoxycholic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H38O4
Net Charge0
Average Mass378.553
Monoisotopic Mass378.27701
SMILES[H][C@@]12C[C@H](O)[C@]3([H])C[C@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)CC(=O)O
InChIInChI=1S/C23H38O4/c1-13(10-21(26)27)16-4-5-17-15-12-20(25)19-11-14(24)6-8-23(19,3)18(15)7-9-22(16,17)2/h13-20,24-25H,4-12H2,1-3H3,(H,26,27)/t13-,14-,15+,16-,17+,18+,19+,20+,22-,23-/m1/s1
InChIKeyZBAVIUQLFUYWMT-NNUWNQTCSA-N
ChEBI Ontology
Outgoing Relation(s)
Norhyodeoxycholic acid (CHEBI:181188) is a cholanoid (CHEBI:36078)
IUPAC Name 
(3R)-3-[(3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]butanoic acid
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LMST04060024LIPID MAPS
81407854ChemSpider