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(5β,7β,12α)-7,12-Dihydroxycholan-24-oic acid
7beta,12alpha-Dihydroxycholanoic acid · (4R)-4-[(5S,7S,8S,9S,10S,12S,13R,14S,17R)-7,12-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]pentanoic acid

Identifikatoren & physikalische Daten
| CAS No. | 84413-81-0 |
|---|---|
| Summenformel | C24H40O4 |
| Durchschnittliche Molmasse | 392,58 g/mol |
| Monoisotopische Masse | 392,29265976 g/mol |
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4CCCC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |
| InChIKey | ZHCAAZIHTDCFJX-BJMHMCHXSA-N |
| PubChem CID | 5283839 |
| ChEBI | CHEBI:175151 |
| DTXSID | DTXSID901255376 |
Chemische & physikalische Eigenschaften
| Siedepunkt | 547.148±35.00 °C(Press: 760.00 Torr)(predicted) |
|---|---|
| Dichte | 1.129±0.06 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
| pKa (Säurekonstante) | 4.758±0.10(predicted) |