Methyl [(2S)-1-{2-Benzyl-2-[(2S)-2-Benzyl-2-Hydroxy-3-{[(1S,2R)-2-Hydroxy-2,3-Dihydro-1H-Inden-1-Yl]Amino}-3-Oxopropyl]Hydrazino}-3-Methyl-1-Oxo-2-Butanyl]Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C33H40N4O6
IUPAC Name methyl n-[(1s)-1-[[benzyl-[(2s)-2-benzyl-2-hydroxy-3-[[(1s,2r)-2-hydroxyindan-1-yl]amino]-3-oxo-propyl]amino]carbamoyl]-2-methyl-propyl]carbamate
Molecular Mass 588.694 g·mol−1
Heat of Formation -881.0 ± 16.7 kJ·mol−1
Dipole Moment 3.54 ± 1.08 D
Volume 705.83 Å 3
Surface Area 472.36 Å 2
HOMO Energy -9.34 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • 6-amino hexanoic acid
  • methyl n-[(1s)-1-[[[(2s)-2-hydroxy-3-[[(1s,2r)-2-hydroxyindan-1-yl]amino]-3-oxo-2-(phenylmethyl)propyl]-(phenylmethyl)amino]carbamoyl]-2-methyl-propyl]carbamate
  • methyl n-[(2s)-1-[2-[(2s)-2-hydroxy-3-[[(1s,2r)-2-hydroxy-2,3-dihydro-1h-inden-1-yl]amino]-3-oxo-2-(phenylmethyl)propyl]-2-(phenylmethyl)hydrazinyl]-3-methyl-1-oxo-butan-2-yl]carbamate
  • methyl n-[(2s)-1-[2-[(2s)-2-hydroxy-3-[[(1s,2r)-2-hydroxy-2,3-dihydro-1h-inden-1-yl]amino]-3-oxo-2-(phenylmethyl)propyl]-2-(phenylmethyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]carbamate
  • n-[(1s)-1-[[benzyl-[(2s)-2-(benzyl)-2-hydroxy-3-[[(1s,2r)-2-hydroxyindan-1-yl]amino]-3-keto-propyl]amino]carbamoyl]-2-methyl-propyl]carbamic acid methyl ester
  • n-[(1s)-1-[[n'-[(2s)-2-hydroxy-3-[[(1s,2r)-2-hydroxy-1-indanyl]amino]-3-oxo-2-(phenylmethyl)propyl]-n'-(phenylmethyl)hydrazino]-oxomethyl]-2-methylpropyl]carbamic acid methyl ester
  • {(1s)-1-[n'-benzyl-n'-((2s)-2-hydroxy-2-((1s,2r)-2-hydroxy-indan-1-ylcarbamoyl)-3-phenylpropyl)-hydrazinocarbonyl]-2-methyl-propyl}-carbamic acid methyl ester
InChIKey KEFISYJDRSSULW-GQPDOWDHSA-N
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