5-[(2-{[(3S)-5-{[(2S)-2-Amino-2-Carboxyethyl]Amino}-3-Carboxy-3-Hydroxy-5-Oxopentanoyl]Amino}Ethyl)Amino]-2,5-Dioxopentanoic Acid

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Properties Simple | Detailed

Formula C16H24N4O11
IUPAC Name (2s)-2-[2-[[(2s)-2-amino-2-carboxy-ethyl]amino]-2-oxo-ethyl]-4-[2-[(4-carboxy-4-oxo-butanoyl)amino]ethylamino]-2-hydroxy-4-oxo-butanoic acid
Molecular Mass 448.382 g·mol−1
Heat of Formation -2056.1 ± 16.7 kJ·mol−1
Dipole Moment 6.61 ± 1.08 D
Volume 504.07 Å 3
Surface Area 456.36 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
InChIKey SIAZVTIHOHTZDD-PWJLMRLQSA-N
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