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2beta,7alpha,12alpha-Trihydroxy-3-oxo-5beta-cholan-24-oic acid

PropertiesImageOccurences in reactions
MNX_IDMNXM27551Image of MNXM27551
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC24H38O6
charge0
mass422.26684
referencechebi:166704
InChIKeyORAGCKFNLGDCMP-NKFQCJGASA-N
InChIInChI=1S/C24H38O6/c1-12(4-7-21(29)30)14-5-6-15-22-16(10-20(28)24(14,15)3)23(2)11-19(27)17(25)8-13(23)9-18(22)26/h12-16,18-20,22,26-28H,4-11H2,1-3H3,(H,29,30)/t12-,13+,14-,15+,16+,18-,19+,20+,22+,23+,24-/m1/s1
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)C[C@H](O)C(=O)C[C@H]1C[C@H]3O
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:166704
chebi:166704 		2beta,7alpha,12alpha-Trihydroxy-3-oxo-5beta-cholan-24-oic acid
(4R)-4-[(2S,5R,7R,8R,9S,10S,12S,13R,14S,17R)-2,7,12-trihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
lipidmaps:LMST04010409
lipidmapsM:LMST04010409 		2beta,7alpha,12alpha-Trihydroxy-3-oxo-5beta-cholan-24-oic Acid
O6
ST 24:2