HIT ID: HIT212675465
Cas No: 130-49-4
分子式: C10H14N5O7P
分子量: 347.224
常用名: Adenosine-2'-monophosphate
氢键受体数 (HBA): 10
氢键供体数 (HBD): 5
LogP: -5.299636
IUPAC: {[(2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid
IUPAC: {[(2R,3R,4R,5R)-2-(6-amino-9H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid
SMILES: Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OP(O)(O)=O
SMILES: Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OP(O)(O)=O
InChI key: QDFHPFSBQFLLSW-KQYNXXCUSA-N