N-(4-{[(2-Amino-5-Methyl-4-Oxo-1,4,5,8-Tetrahydro-6-Pteridinyl)Methyl]Amino}Benzoyl)-L-Glutamic Acid

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Properties Simple | Detailed

Formula C20H23N7O6
IUPAC Name (2s)-2-[[4-[(2-λ1-azanyl-5-methyl-4-oxo-1h-pteridine-3,5,8-triium-6-yl)methylamino]benzene-6-ide-1-carbonyl]amino]pentanedioate
Molecular Mass 457.440 g·mol−1
Heat of Formation -754.1 ± 16.7 kJ·mol−1
Dipole Moment 13.46 ± 1.08 D
Volume 516.85 Å 3
Surface Area 457.97 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[4-[(2-amino-4-keto-5-methyl-1,8-dihydropteridin-6-yl)methylamino]benzoyl]amino]glutaric acid
  • (2s)-2-[[4-[(2-amino-5-methyl-4-oxo-1,8-dihydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
  • (2s)-2-[[4-[(2-amino-5-methyl-4-oxo-1,8-dihydropteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid
  • (2s)-2-[[[4-[(2-amino-5-methyl-4-oxo-1,8-dihydropteridin-6-yl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid
  • 5-methyldihydrofolate
  • l-glutamic acid, n-(4-(((2-amino-1,4,5,8-tetrahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-
  • n-(4-(((2-amino-1,4,5,8-tetrahydro-5-methyl-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-l-glutamic acid
CAS Number(s)
  • 59904-24-4
InChIKey VWNDXSYYCICZGD-ZDUSSCGKSA-N
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