avenasterol
Chemical Formula:
C29H48O
Molecular Weight:
412.698 Daltons
Monoisotopic Mass:
412.3705161629 Daltons
SMILES:
CC=C(C(C)C)CCC(C)[CH]3(CC[CH]4(C2(=CC[CH]1(CC(O)CCC(C)1[CH]2CCC(C)34))))
InChI:
1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,11,19-20,22-23,25-27,30H,8-10,12-18H2,1-6H3/b21-7-/t20-,22+,23+,25-,26+,27+,28+,29-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-4125
PubChem (CID):
12795736
HMDB:
HMDB06851
KEGG:
C15782
ChEBI:
80096