N-[4-({[(6R)-2-Amino-5-Methyl-4-Oxo-3,4,5,6,7,8-Hexahydro-6-Pteridinyl]Methyl}Amino)Benzoyl]-D-Glutamic Acid

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Properties Simple | Detailed

Formula C20H25N7O6
IUPAC Name (2r)-2-[[4-[[(5r,6r)-2-amino-5-methyl-4-oxo-7,8-dihydro-6h-pteridin-1-ium-3-id-6-yl]methylamino]benzoyl]amino]pentanedioic acid
Molecular Mass 459.456 g·mol−1
Heat of Formation -827.0 ± 16.7 kJ·mol−1
Dipole Moment 9.78 ± 1.08 D
Volume 518.72 Å 3
Surface Area 459.25 Å 2
HOMO Energy -8.23 ± 0.55 eV
LUMO Energy 2.71 ± eV
Point Group Symmetry C1
InChIKey ZNOVTXRBGFNYRX-CHWSQXEVSA-N
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