3-oxo-24-ethyl-cholest-4-ene
Chemical Formula:
C29H48O
Molecular Weight:
412.698 Daltons
Monoisotopic Mass:
412.3705161629 Daltons
SMILES:
CCC(C(C)C)CCC(C)[CH]3(CC[CH]4([CH]2(CCC1(=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/h18-21,24-27H,7-17H2,1-6H3/t20-,21-,24+,25-,26+,27+,28+,29-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-13794
ChEBI:
68105
PubChem (CID):
5484202
Seed:
cpd24046
HMDB:
HMDB33934
MetaNetX:
MNXM103173