N-[(Benzyloxy)Carbonyl]-3-[(2,2-Dimethylpropanoyl)Amino]-L-Alanyl-N-{(2R)-5-Oxo-1-[(3S)-2-Oxo-3-Pyrrolidinyl]-2-Hexanyl}-L-Leucinamide

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Properties Simple | Detailed

Formula C32H49N5O7
IUPAC Name benzyl n-[(1s)-1-[(2,2-dimethylpropanoylamino)methyl]-2-[[(1s)-3-methyl-1-[[(1r)-4-oxo-1-[[(3s)-2-oxopyrrolidin-3-yl]methyl]pentyl]carbamoyl]butyl]amino]-2-oxo-ethyl]carbamate
Molecular Mass 615.761 g·mol−1
Heat of Formation -1473.4 ± 16.7 kJ·mol−1
Dipole Moment 4.99 ± 1.08 D
Volume 783.75 Å 3
Surface Area 650.87 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
InChIKey IEQRDAZPCPYZAJ-QYOOZWMWSA-N
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