N-(1-Carboxy-3-Phenylpropyl)-L-Isoleucyl-L-Tryptophan

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Properties Simple | Detailed

Formula C27H33N3O5
IUPAC Name (2s)-2-[[(2s,3r)-2-[[(1s)-1-carboxy-3-phenyl-propyl]amino]-3-methyl-pentanoyl]amino]-3-(6h-indol-1-ium-7a-ylium-6-id-3-yl)propanoate
Molecular Mass 479.568 g·mol−1
Heat of Formation -826.1 ± 16.7 kJ·mol−1
Dipole Moment 4.36 ± 1.08 D
Volume 604.47 Å 3
Surface Area 450.96 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
InChIKey VSKDBFPGGSBFRY-WFBMQCHUSA-N
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