N-[(5S)-5-(Benzoylamino)-4,4-Dihydroxy-6-Phenylhexanoyl]-L-Tryptophan

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Properties Simple | Detailed

Formula C30H31N3O6
IUPAC Name (2s)-2-[[(5s)-5-benzamido-4,4-dihydroxy-6-phenyl-hexanoyl]amino]-3-indol-1-ium-7a-ylium-3-yl-propanoic acid
Molecular Mass 529.584 g·mol−1
Heat of Formation -918.5 ± 16.7 kJ·mol−1
Dipole Moment 4.11 ± 1.08 D
Volume 637.0 Å 3
Surface Area 448.08 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
InChIKey YDVCMWDLPUDBQG-UIOOFZCWSA-N
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