ST005195 1,2,6,6,10,17,20-heptamethyl-12-oxo-17-[(6-oxo-7,11-diazatricyclo[7.3.1.0 ]trideca-2,4-dien-11-yl)carbonyl]pentacyclo[12.8.0.0.0.0]do cos-13-en-7-yl acetate

Formula: C43H60N2O5

MW: 684.96

MDL: MFCD01459813

TNP:

LogP: 1.8

LogS: -3.38

Acceptors: 5

Donors: 0

Rotation Bonds: 3

Chiral Centers: 11

N+O: 7

LIPINSKY: 3

IUPAC: 1,2,6,6,10,17,20-heptamethyl-12-oxo-17-[(6-oxo-7,11-diazatricyclo[7.3.1.0<2,7> ]trideca-2,4-dien-11-yl)carbonyl]pentacyclo[12.8.0.0<2,11>.0<5,10>.0<15,20>]do cos-13-en-7-yl acetate

Smiles: C=12C(C3(CCC4C(C3C(C1)=O)(CCC(OC(=O)C)C4(C)C)C)C)(CCC1(C2CC(C(N2CC3c4cccc(n4CC(C2)C3)=O)=O)(C)CC1)C)C

Chemical Compounds - Natural Compounds