HIT ID: HIT214317732
Cas No: 58602-66-7
分子式: C19H20N8NaO5
分子量: 463.41
常用名: Aminopterin sodium
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S)-2-[(4-{[(2,4-diaminopteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid sodium
IUPAC: (2S)-2-[(4-{[(2,4-diaminopteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid sodium
SMILES: [Na].Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
SMILES: [Na].Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
InChI key: LKGZWKSUDHJRCB-YDALLXLXSA-N