ST005205 1,2,6,6,10,17,20-heptamethyl-12-oxo-17-{[2-(6-oxo-7,11-diazatricyclo[7.3.1.0]trideca-2,4-dien-11-yl)ethyl]oxycarbonyl}pentacyclo[12.8.0.0.0 .0]docos-13-en-7-yl acetate

Formula: C45H64N2O6

MW: 729.01

MDL: MFCD01459823

TNP:

LogP: 0.67

LogS: -3.33

Acceptors: 6

Donors: 0

Rotation Bonds: 7

Chiral Centers: 11

N+O: 8

LIPINSKY: 3

IUPAC: 1,2,6,6,10,17,20-heptamethyl-12-oxo-17-{[2-(6-oxo-7,11-diazatricyclo[7.3.1.0<2 ,7>]trideca-2,4-dien-11-yl)ethyl]oxycarbonyl}pentacyclo[12.8.0.0<2,11>.0<5,10> .0<15,20>]docos-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(=O)OCCN2CC3c4cccc(n4CC(C2)C3)=O)(C)CC1)C)C

Chemical Compounds - Natural Compounds