5-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}chromen-4-one, Iristectorin A-6''-O-glucoside
HIT218832766
sdf文件结构编辑类似物检索
HIT ID: HIT218832766
Cas No:
分子式: C29H34O17
分子量: 654.574
常用名: 5-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}chromen-4-one, Iristectorin A-6''-O-glucoside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one
SMILES: COc1ccc(cc1O)-c1coc2cc(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)c(OC)c(O)c2c1=O
InChI key: DARREVOKIDQGOV-UHFFFAOYSA-N
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