HIT ID: HIT214314754
Cas No: 1185242-90-3
分子式: C17H20O6
分子量: 323.359
常用名: Mycophenolic acid-d3
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6-[4-hydroxy-6-(2H3)methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl]-4-methylhex-4-enoic acid
IUPAC: 6-[4-hydroxy-6-(2H3)methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl]-4-methylhex-4-enoic acid
SMILES: [2H]C([2H])([2H])Oc1c(C)c2COC(=O)c2c(O)c1CC=C(C)CCC(O)=O |w:18.19|
SMILES: [2H]C([2H])([2H])Oc1c(C)c2COC(=O)c2c(O)c1CC=C(C)CCC(O)=O |w:18.19|
InChI key: HPNSFSBZBAHARI-HPRDVNIFSA-N