N-(4-Morpholinylacetyl)-L-Alanyl-N-[(2S,4R)-1-Cyclohexyl-5-Hydroxy-4-Methyl-3-Oxo-2-Pentanyl]-O-Methyl-L-Tyrosinamide

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Properties Simple | Detailed

Formula C31H48N4O7
IUPAC Name (2s)-n-[(1s,3r)-1-(cyclohexylmethyl)-4-hydroxy-3-methyl-2-oxo-butyl]-3-(4-methoxyphenyl)-2-[[(2s)-2-[(2-morpholinoacetyl)amino]propanoyl]amino]propanamide
Molecular Mass 588.735 g·mol−1
Heat of Formation -1337.7 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 752.01 Å 3
Surface Area 566.91 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 0.30 ± eV
Point Group Symmetry C1
InChIKey CTVSVADXPCPAKI-SEEQBUNISA-N
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