1,6-Bis-O-(4-hydroxycinnamoyl)glucose
HIT102355504
sdf文件结构编辑类似物检索
HIT ID: HIT102355504
Cas No: n.g.
分子式: C24H24O10
分子量: 472.446
常用名: 1,6-Bis-O-(4-hydroxycinnamoyl)glucose
常用名: 1,6-Bis-O-(4-hydroxycinnamoyl)glucose
氢键受体数 (HBA): 8
氢键供体数 (HBD): 5
LogP: 2.528
IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]methyl (2E)-3-(4-hydroxyphenyl)prop-2-enoate
IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]methyl (2E)-3-(4-hydroxyphenyl)prop-2-enoate
SMILES: O[C@@H]1[C@@H](COC(=O)\C=C\c2ccc(O)cc2)O[C@@H](OC(=O)\C=C\c2ccc(O)cc2)[C@H](O)[C@H]1O
SMILES: O[C@@H]1[C@@H](COC(=O)\C=C\c2ccc(O)cc2)O[C@@H](OC(=O)\C=C\c2ccc(O)cc2)[C@H](O)[C@H]1O
InChI key: IAVJHQVGTRSIOM-UVMZMRPTSA-N
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