HIT ID: HIT102963092
Cas No: 58957-07-6
分子式: C12H14O4
分子量: 222.24
常用名: Dihydrodeoxy-8-epiaustdiol
氢键受体数 (HBA): 4
氢键供体数 (HBD): 2
LogP: -0.16
IUPAC: (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-7,8-dihydro-6H-isochromen-6-one
IUPAC: (7R,8R)-7,8-dihydroxy-3,5,7-trimethyl-7,8-dihydro-6H-isochromen-6-one
SMILES: CC1=CC2=C(C)C(=O)[C@](C)(O)[C@H](O)C2=CO1 |c:3,14,t:1|
SMILES: CC1=CC2=C(C)C(=O)[C@](C)(O)[C@H](O)C2=CO1 |c:3,14,t:1|
InChI key: JVUYBLROBHJEJN-NEPJUHHUSA-N