HIT ID: HIT212670677
Cas No: 31858-66-9
分子式: C18H22O6
分子量: 334.368
常用名: Methyl mycophenolate
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 3.6734915
IUPAC: methyl (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoate
IUPAC: methyl (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoate
SMILES: COC(=O)CC\C(C)=C\Cc1c(O)c2C(=O)OCc2c(C)c1OC
SMILES: COC(=O)CC\C(C)=C\Cc1c(O)c2C(=O)OCc2c(C)c1OC
InChI key: ZPXRQFLATDNYSS-BJMVGYQFSA-N