HIT ID: HIT212658811
Cas No: 25899-70-1
分子式: C10H11N4Na2O9P
分子量: 408.17
常用名: Xanthosine 5'-monophosphate sodium salt
常用名: Xanthosine 5'-monophosphate sodium salt
氢键受体数 (HBA): 9
氢键供体数 (HBD): 4
LogP: -2.178401
IUPAC: disodium 9-{3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}-9H-purine-2,6-bis(olate)
IUPAC: disodium 9-{3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}-9H-purine-2,6-bis(olate)
SMILES: [Na+].[Na+].OC1C(COP(O)(O)=O)OC(C1O)n1cnc2c([O-])nc([O-])nc12
SMILES: [Na+].[Na+].OC1C(COP(O)(O)=O)OC(C1O)n1cnc2c([O-])nc([O-])nc12
InChI key: QQPVYRBCIRHGSZ-UHFFFAOYSA-L
