HIT ID: HIT214323989
Cas No: 666847-71-8
分子式: C13H20N7O13P3
分子量: 575.26
常用名: 5-Propargylamino-3'-azidomethyl-dCTP
常用名: 5-Propargylamino-3'-azidomethyl-dCTP
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: ({[({[(2R,3S,5R)-5-[4-amino-5-(3-aminoprop-1-yn-1-yl)-2-oxo-1,2-dihydropyrimidin-1-yl]-3-(azidomethoxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
IUPAC: ({[({[(2R,3S,5R)-5-[4-amino-5-(3-aminoprop-1-yn-1-yl)-2-oxo-1,2-dihydropyrimidin-1-yl]-3-(azidomethoxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
SMILES: NCC#Cc1cn([C@H]2C[C@H](OCN=[N+]=[N-])[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)c(=O)nc1N
SMILES: NCC#Cc1cn([C@H]2C[C@H](OCN=[N+]=[N-])[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)c(=O)nc1N
InChI key: SHCGONLEPWBTFI-HBNTYKKESA-N
