(4S)-5-[[(1S)-1-Benzyl-2-Oxo-2-[[(Z,1S)-4-Oxo-4-Phenyl-1-Propyl-But-2-Enyl]Amino]Ethyl]Amino]-4-(Benzyloxycarbonylamino)-5-Oxo-Pentanoic Acid

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Properties Simple | Detailed

Formula C35H39N3O7
IUPAC Name (4s)-5-[[(1s)-1-benzyl-2-oxo-2-[[(z,1s)-4-oxo-4-phenyl-1-propyl-but-2-enyl]amino]ethyl]amino]-4-(benzyloxycarbonylamino)-5-oxo-pentanoic acid
Molecular Mass 613.700 g·mol−1
Heat of Formation -1026.4 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 765.53 Å 3
Surface Area 621.76 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
InChIKey LKWUEIKYVLZLJI-VFVVKUBXSA-N
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