Nalpha-[(2S)-2-{[(R)-[(1R)-1-Amino-3-Phenylpropyl](Hydroxy)Phosphoryl]Methyl}-4-Methylpentanoyl]-L-Tryptophanamide

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Properties Simple | Detailed

Formula C27H37N4O4P
IUPAC Name [(2s)-2-[[(1s)-2-amino-1-(indol-1-ium-3-ylmethyl)-2-oxo-ethyl]carbamoyl]-4-methyl-pentyl]-[(1r)-1-amino-3-phenyl-propyl]phosphinic acid
Molecular Mass 512.581 g·mol−1
Heat of Formation -823.4 ± 16.7 kJ·mol−1
Dipole Moment 2.49 ± 1.08 D
Volume 643.02 Å 3
Surface Area 486.17 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.11 ± eV
Point Group Symmetry C1
InChIKey QKFOTLXPIIESQI-IEZKXTBUSA-N
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