6-[2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate, beta-Hydroxyacteoside
HIT218679480
sdf文件结构编辑类似物检索
HIT ID: HIT218679480
Cas No:
分子式: C29H36O16
分子量: 640.591
常用名: 6-[2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate, beta-Hydroxyacteoside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 6-[2-(3,4-dihydroxyphenyl)-2-hydroxyethoxy]-5-hydroxy-2-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate
SMILES: CC1OC(OC2C(O)C(OCC(O)c3ccc(O)c(O)c3)OC(CO)C2OC(=O)C=Cc2ccc(O)c(O)c2)C(O)C(O)C1O
InChI key: XDAXWJHQKZRSEY-UHFFFAOYSA-N
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