2-{[3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol, Symplocoside
HIT218832775
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HIT ID: HIT218832775
Cas No:
分子式: C22H26O11
分子量: 466.439
常用名: 2-{[3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol, Symplocoside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 2-{[3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
SMILES: COc1cc(ccc1O)C1Oc2cc(OC3OC(CO)C(O)C(O)C3O)cc(O)c2CC1O
InChI key: NSWUFLQDWPOETD-UHFFFAOYSA-N
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