12,13β-epoxy-16β-hydroxy-β-amyrin
Chemical Formula:
C30H50O3
Molecular Weight:
458.723 Daltons
Monoisotopic Mass:
458.3759954713 Daltons
SMILES:
CC3(C[CH]4(C26(OC(C[CH]5(C1(CCC(C([CH]1CCC(C2(CC(O)C(C)(CC3)4)C)5C)(C)C)O)C))6)))C
InChI:
1S/C30H50O3/c1-24(2)13-14-27(6)20(16-24)30-23(33-30)15-19-26(5)11-10-21(31)25(3,4)18(26)9-12-28(19,7)29(30,8)17-22(27)32/h18-23,31-32H,9-17H2,1-8H3/t18-,19+,20+,21-,22-,23+,26-,27-,28+,29-,30+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-16622
PubChem (CID):
90658344
MetaNetX:
MNXM146862