ST087943 2-{8-[(1E)-3-(3,8-dimethyladamantanyl)-2-azaprop-1-enyl]-1,6,7-trihydroxy-3-me thyl-5-(methylethyl)(2-naphthyl)}-8-[(1E)-2-(3,8-dimethyladamantanyl)-2-azavin yl]-3-methyl-5-(methylethyl)naphthalene-1,6,7-triol

Formula: C55H70N2O6

MW: 855.17

LogP: 7.37

LogS: -7.1

Acceptors: 6

Donors: 6

Rotation Bonds: 14

Chiral Centers: 4

N+O: 8

LIPINSKY: 1

IUPAC: 2-{8-[(1E)-3-(3,8-dimethyladamantanyl)-2-azaprop-1-enyl]-1,6,7-trihydroxy-3-me thyl-5-(methylethyl)(2-naphthyl)}-8-[(1E)-2-(3,8-dimethyladamantanyl)-2-azavin yl]-3-methyl-5-(methylethyl)naphthalene-1,6,7-triol

Smiles: c1(c(/C=N\C23CC4(CC(C2)CC(C3)(C4)C)C)c2c(c(c3c(cc4c(c(c(O)c(O)c4C(C)C)/C=N\CC45CC6(CC(C4)CC(C5)(C6)C)C)c3O)C)c(C)cc2c(C(C)C)c1O)O)O

Chemical Compounds - Natural Compounds