HIT ID: HIT100035076

Cas No: 22738-98-3

分子式: C25H31ClO6

分子量: 462.97

常用名: Ilicicolin F

氢键受体数 (HBA): 5

氢键供体数 (HBD): 2

LogP: 5.943

IUPAC: (1S,2S,3S,4R)-3-[(1E,3E)-5-(3-chloro-5-formyl-2,6-dihydroxy-4-methylphenyl)-3-methylpenta-1,3-dien-1-yl]-2,3,4-trimethyl-5-oxocyclohexyl acetate

SMILES: C[C@@H]1[C@H](CC(=O)[C@H](C)[C@@]1(C)\C=C\C(\C)=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O)OC(C)=O

InChI key: ACSLMZYXJATICN-IRMIYARYSA-N