Ptga

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Formula C29H33N9O12+
IUPAC Name (2s)-2-[[(4s)-4-[[(4s)-4-[[4-[(2-amino-4-oxo-pteridin-6-yl)methylamino]benzoyl]amino]-4-carboxy-butanoyl]amino]-4-carboxy-butanoyl]amino]pentanedioic acid
Molecular Mass 699.625 g·mol−1
Heat of Formation -1927.9 ± 16.7 kJ·mol−1
Dipole Moment 9.88 ± 1.08 D
Volume 779.6 Å 3
Surface Area 684.04 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -1.49 ± eV
Point Group Symmetry C1
InChIKey WOLQREOUPKZMEX-BZSNNMDCSA-N
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