HIT ID: HIT101000195

Cas No: 510-19-0

分子式: C15H27NO5

分子量: 301.383

常用名: (1R,7aS)-1-{[(2,3-dihydroxy-2-isopropylbutanoyl)oxy]methyl}-hexahydro-1H-pyrrolizin-4-ium-4-olate, N037-0025

氢键受体数 (HBA): 6

氢键供体数 (HBD): 2

LogP: 0.8918

IUPAC: (1R,7aS)-1-({[2,3-dihydroxy-2-(propan-2-yl)butanoyl]oxy}methyl)-octahydropyrrolizin-4-ium-4-olate

SMILES: CC(C)C(O)(C(C)O)C(=O)OC[C@@H]1CC[N+]2([O-])CCC[C@@H]12

InChI key: DLNWZIVYKQXLTN-IKZJNQNNSA-N