N-Butyl-3-Hydroxy-6-Methyl-4-{[N-(2-Naphthylacetyl)-L-Isoleucyl]Amino}Heptanamide

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Formula C30H45N3O4
IUPAC Name (3s,4s)-n-butyl-3-hydroxy-6-methyl-4-[[(2s,3s)-3-methyl-2-[[2-(2-naphthyl)acetyl]amino]pentanoyl]amino]heptanamide
Molecular Mass 511.696 g·mol−1
Heat of Formation -920.7 ± 16.7 kJ·mol−1
Dipole Moment 3.09 ± 1.08 D
Volume 685.74 Å 3
Surface Area 545.62 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
InChIKey YHTKRGDAFFBWEU-KXDOSHFCSA-N
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