β-seco-amyrin
Chemical Formula:
C30H50O
Molecular Weight:
426.724 Daltons
Monoisotopic Mass:
426.3861662271 Daltons
SMILES:
CC3(=C(CC[CH]2(C1(CCC(C([CH]1CC=C2C)(C)C)O)C))[CH]4(C(CC3)(CCC(C)(C)C4)C))
InChI:
1S/C30H50O/c1-20-13-15-29(7)18-17-27(3,4)19-24(29)22(20)10-11-23-21(2)9-12-25-28(5,6)26(31)14-16-30(23,25)8/h9,23-26,31H,10-19H2,1-8H3/t23-,24-,25-,26-,29-,30+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-13883
KEGG:
C20193
PubChem (CID):
56927810
ChEBI:
63466
MetaNetX:
MNXM5075