3,7-Dihydroxy-20,22-Methylenecholan-23-Oic Acid
[CAS# 95498-96-7]

Identification

• Name: 3,7-Dihydroxy-20,22-Methylenecholan-23-Oic Acid
• Synonyms: 2-[(3R,5S,7S,10S,13S,17S)-3,7-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]-2-Methyl-Cyclopropane-1-Carboxylic Acid; 2-[(3R,5S,7S,10S,13S,17S)-3,7-Dihydroxy-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12
• Molecular Formula: C₂₄H₃₈O₄
• Molecular Weight: 390.56
• CAS Registry Number: 95498-96-7
• SMILES: [C@]25([C@@H](C1(C(C1)C(=O)O)C)CCC2C3C([C@@]4([C@H](C[C@@H]3O)C[C@H](O)CC4)C)CC5)C
• InChI: 1S/C24H38O4/c1-22-8-6-14(25)10-13(22)11-18(26)20-15-4-5-19(23(15,2)9-7-16(20)22)24(3)12-17(24)21(27)28/h13-20,25-26H,4-12H2,1-3H3,(H,27,28)/t13-,14+,15?,16?,17?,18-,19-,20?,22-,23-,24?/m0/s1
• InChIKey: WLGCTZBTSBEUDJ-DTDARERJSA-N