Glycerophosphoinositol choline
HIT212716245
sdf文件结构编辑类似物检索
HIT ID: HIT212716245
Cas No: 425642-32-6
分子式: C14H32NO12P
分子量: 437.379
常用名: Glycerophosphoinositol choline
氢键受体数 (HBA): 9
氢键供体数 (HBD): 7
LogP: -4.848052
IUPAC: (1R,2R,3S,4S,5R,6S)-6-({[(2R)-2,3-dihydroxypropoxy](oxido)phosphoryl}oxy)cyclohexane-1,2,3,4,5-pentol; (2-hydroxyethyl)trimethylazanium
IUPAC: (1R,2R,3S,4S,5R,6S)-6-({[(2R)-2,3-dihydroxypropoxy](oxido)phosphoryl}oxy)cyclohexane-1,2,3,4,5-pentol; (2-hydroxyethyl)trimethylazanium
SMILES: C[N+](C)(C)CCO.OC[C@@H](O)COP([O-])(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
SMILES: C[N+](C)(C)CCO.OC[C@@H](O)COP([O-])(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
InChI key: PTZZCYHESHNXFL-RCEFGWESSA-M
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