HIT ID: HIT212522708
Cas No: 267881-26-5
分子式: C14H14Cl2O5
分子量: 333.16
常用名: 3',3'-Dichloro-8-O-methyldiaporthin
常用名: 3',3'-Dichloro-8-O-methyldiaporthin
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 2.346
IUPAC: 3-(3,3-dichloro-2-hydroxypropyl)-6,8-dimethoxy-1H-isochromen-1-one
IUPAC: 3-(3,3-dichloro-2-hydroxypropyl)-6,8-dimethoxy-1H-isochromen-1-one
SMILES: COc1cc(OC)c2c(c1)cc(CC(O)C(Cl)Cl)oc2=O
SMILES: COc1cc(OC)c2c(c1)cc(CC(O)C(Cl)Cl)oc2=O
InChI key: MOLWVPJZUNCMGV-UHFFFAOYSA-N
