N-[4-({[(6S)-2-Amino-5-Methyl-4-Oxo-1,4,5,6,7,8-Hexahydro-6-Pteridinyl]Methyl}Amino)Benzoyl]-L-γ-Glutamyl-L-Glutamic Acid

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Properties Simple | Detailed

Formula C25H33N8O9+
IUPAC Name (2s)-2-[[(4s)-4-[[4-[[(6s)-2-amino-5-methyl-4-oxo-7,8-dihydro-6h-pteridin-1-ium-4a-ylium-6-yl]methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid
Molecular Mass 589.578 g·mol−1
Heat of Formation -1421.7 ± 16.7 kJ·mol−1
Dipole Moment 7.22 ± 1.08 D
Volume 670.47 Å 3
Surface Area 583.64 Å 2
HOMO Energy -8.22 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
InChIKey VNEFZDDORGCJSD-JYJNAYRXSA-N
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