1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane-3,5-diyl diacetate
HIT213887180
sdf文件结构编辑类似物检索
HIT ID: HIT213887180
Cas No: 1269839-26-0
分子式: C23H28O7
分子量: 416.47
常用名: 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane-3,5-diyl diacetate
常用名: 1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane-3,5-diyl diacetate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3R,5R)-5-(acetyloxy)-7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)heptan-3-yl acetate
IUPAC: (3R,5R)-5-(acetyloxy)-7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)heptan-3-yl acetate
SMILES: CC(=O)O[C@H](CCc1ccc(O)cc1)C[C@@H](CCc1ccc(O)c(O)c1)OC(C)=O
SMILES: CC(=O)O[C@H](CCc1ccc(O)cc1)C[C@@H](CCc1ccc(O)c(O)c1)OC(C)=O
InChI key: PBCHINDGXDDCEA-NHCUHLMSSA-N
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