HIT ID: HIT212666832
Cas No: 31690-09-2;134-35-0
分子式: C20H25N7O6
分子量: 459.463
常用名: 5-Methyltetrahydrofolic acid
氢键受体数 (HBA): 12
氢键供体数 (HBD): 7
LogP: -1.8728338
IUPAC: (2S)-2-[(4-{[(2-amino-5-methyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid
IUPAC: (2S)-2-[(4-{[(2-amino-5-methyl-4-oxo-1,4,5,6,7,8-hexahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid
SMILES: CN1C(CNc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CNc2[nH]c(N)nc(=O)c12
SMILES: CN1C(CNc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CNc2[nH]c(N)nc(=O)c12
InChI key: ZNOVTXRBGFNYRX-ABLWVSNPSA-N
