HIT ID: HIT101420085

Cas No: 18463-25-7

分子式: C20H22O9

分子量: 406.387

常用名: Nigracin

氢键受体数 (HBA): 8

氢键供体数 (HBD): 5

LogP: 0.826

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-hydroxy-2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl benzoate

SMILES: OCc1cc(O)ccc1O[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1O

InChI key: FLROYCKIIJCTDY-BFMVXSJESA-N