| Compound-ID | 24751 |
| Common Name | 3-Oxocholic acid |
| Synonyms |
7alpha,12alpha-Dihydroxy-3-oxo-5beta-cholanate
7alpha,12alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic acid 7,12-Dihydroxy-3-oxocholanic acid |
| InChI |
InChI=1S/C24H38O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-20,22,26-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1
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| SMILES |
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCC(=O)C4)C)O)O)C
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| External Links | |
| PUBCHEM-CID | 5283956 |
| ChEBI-ID |
88108
88108 |
| METANETX-ID | MNXM166689 |
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View all entries for compound: 3-Oxocholic acid |