2-methyldiplopterol
Chemical Formula:
C31H54O
Molecular Weight:
442.767 Daltons
Monoisotopic Mass:
442.4174663555 Daltons
SMILES:
CC4(CC(C)(C)[CH]5(CCC2(C)([CH](CC[CH]1(C3(C)(CCC(C(C)(C)O)[CH](CCC(C)12)3)))C(C)(C4)5)))
InChI:
1S/C31H54O/c1-20-18-26(2,3)23-14-17-31(9)25(29(23,7)19-20)11-10-24-28(6)15-12-21(27(4,5)32)22(28)13-16-30(24,31)8/h20-25,32H,10-19H2,1-9H3/t20?,21-,22-,23-,24+,25+,28-,29-,30+,31+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-14518
PubChem (CID):
90658579
MetaNetX:
MNXM97650