HIT218679383 - 2-{[2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxyoxan-4-yl]oxy}-6-methyloxane-3,4,5-triol, Peiioside B

sdf文件结构编辑类似物检索

HIT ID: HIT218679383

Cas No:

分子式: C25H38O16

分子量: 594.563

常用名: 2-{[2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxyoxan-4-yl]oxy}-6-methyloxane-3,4,5-triol, Peiioside B

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: 2-{[2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxyoxan-4-yl]oxy}-6-methyloxane-3,4,5-triol

SMILES: CC1OC(OC2C(O)C(COC3OCC(O)(CO)C3O)OC(OCCc3ccc(O)c(O)c3)C2O)C(O)C(O)C1O

InChI key: MDGFXWIFYYDOTA-UHFFFAOYSA-N