Soyasapogenol C
[CAS# 595-14-2]

Identification

• Name: Soyasapogenol C
• Synonyms: (3S,4S,4Ar,6Ar,6Bs,8As,12Ar,14Ar,14Br)-4,6A,6B,8A,11,11,14B-Heptamethyl-4-Methylol-1,2,3,4A,5,6,7,8,12,12A,14,14A-Dodecahydropicen-3-Ol; Oleana-12,21-Diene-3,23-Diol, (3Beta,4Beta)-; Sapogenol C
• Molecular Formula: C₃₀H₄₈O₂
• Molecular Weight: 440.71
• CAS Registry Number: 595-14-2
• SMILES: [C@]25(C(=CC[C@@H]3[C@]1(CC[C@@H]([C@@]([C@@H]1CC[C@@]23C)(CO)C)O)C)[C@@H]4CC(C)(C)C=C[C@@]4(CC5)C)C
• InChI: 1S/C30H48O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,14-15,21-24,31-32H,9-13,16-19H2,1-7H3/t21-,22+,23+,24-,26+,27-,28+,29+,30+/m0/s1
• InChIKey: VNGUCOGHCJHFID-FLZFTVBESA-N