(2S)-2-[(4-{[(2-Amino-7-Methyl-4-Oxo-1,4,7,8-Tetrahydro-6-Pteridinyl)Methyl]Amino}Benzoyl)Amino]Pentanedioate

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Properties Simple | Detailed

Formula C20H22N7O6
IUPAC Name 4-[[(7r)-2-amino-7-methyl-4-oxo-7,8-dihydro-1h-pteridine-3,5-diium-8a-id-6-yl]methylamino]-n-cyclopropyl-benzamide; carbon dioxide
Molecular Mass 456.432 g·mol−1
Heat of Formation -627.2 ± 16.7 kJ·mol−1
Dipole Moment 12.46 ± 1.08 D
Volume 530.09 Å 3
Surface Area 471.95 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
InChIKey FMNVDMRUKQPXQP-CABZTGNLSA-L
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