N-(4-{[2-(2-Amino-4-Oxo-1,4-Dihydro-6-Pteridinyl)Ethyl]Amino}Benzoyl)-L-Glutamic Acid

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Properties Simple | Detailed

Formula C20H21N7O6
IUPAC Name (2s)-2-[[4-[2-(2-amino-4-oxo-pteridin-1-ium-3-id-6-yl)ethylamino]benzoyl]amino]pentanedioic acid
Molecular Mass 455.424 g·mol−1
Heat of Formation -752.7 ± 16.7 kJ·mol−1
Dipole Moment 9.97 ± 1.08 D
Volume 511.66 Å 3
Surface Area 456.87 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -1.50 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[4-[2-(2-amino-4-keto-1h-pteridin-6-yl)ethylamino]benzoyl]amino]glutaric acid
  • (2s)-2-[[4-[2-(2-amino-4-oxo-1h-pteridin-6-yl)ethylamino]benzoyl]amino]pentanedioic acid
  • (2s)-2-[[4-[2-(2-amino-4-oxo-1h-pteridin-6-yl)ethylamino]phenyl]carbonylamino]pentanedioic acid
  • (2s)-2-[[[4-[2-(2-amino-4-oxo-1h-pteridin-6-yl)ethylamino]phenyl]-oxomethyl]amino]pentanedioic acid
  • 2-glutamic acid, n-(4-(2-(2-amino-1,4-dihydro-4-oxo-6-pteridinyl)ethylamino)benzoyl)- (9ci)
  • 9-methylfolic acid
  • glutamic acid, n-(p-((2-(2-amino-4-hydroxy-6-pteridinyl)ethyl)amino)benzoyl)-
  • l-glutamic acid, n-(4-((2-(2-amino-1,4-dihydro-4-oxo-6-pteridinyl)ethyl)amino)benzoyl)- (9ci)
InChIKey QXARTGUOGAZGKO-ZDUSSCGKSA-N
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