Diadenosine pentaphosphate pentalithium
HIT218886905
sdf文件结构编辑类似物检索
HIT ID: HIT218886905
Cas No:
分子式: C20H24Li5N10O22P5
分子量: 946.03
常用名: Diadenosine pentaphosphate pentalithium
常用名: Diadenosine pentaphosphate pentalithium
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: pentalithium(1+) ({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)(oxido)phosphoryl]oxy}(oxido)phosphoryl)oxy]phosphinate
IUPAC: pentalithium(1+) ({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)[({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)(oxido)phosphoryl]oxy}(oxido)phosphoryl)oxy]phosphinate
SMILES: [Li+].[Li+].[Li+].[Li+].[Li+].Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O
SMILES: [Li+].[Li+].[Li+].[Li+].[Li+].Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](O)[C@H]1O
InChI key: UCSIUKZZDLEYFE-CSMIRWGRSA-I
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