Methyl N-{[(2S,3S)-3-({(2S)-1-[(2S)-2-Carboxy-1-Pyrrolidinyl]-4-Methyl-1-Oxo-2-Pentanyl}Carbamoyl)-2-Oxiranyl]Carbonyl}-L-Leucylglycylglycinate

Molecule SVG Image

Properties Simple | Detailed

Formula C26H41N5O10
IUPAC Name (2s)-1-[(2s)-2-[[(2s,3s)-3-[[(1s)-1-[[2-[(2-methoxy-2-oxo-ethyl)amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]oxirane-2-carbonyl]amino]-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid
Molecular Mass 583.631 g·mol−1
Heat of Formation -1859.2 ± 16.7 kJ·mol−1
Dipole Moment 7.98 ± 1.08 D
Volume 713.46 Å 3
Surface Area 564.48 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 0.57 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1-[(2s)-2-[[(2s,3s)-3-[[(1s)-1-[[2-[(2-methoxy-2-oxo-ethyl)amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]oxirane-2-carbonyl]amino]-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-2-[[(2s,3s)-3-[[(1s)-1-[[2-keto-2-[(2-keto-2-methoxy-ethyl)amino]ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]oxirane-2-carbonyl]amino]-4-methyl-pentanoyl]proline
  • (2s)-1-[(2s)-2-[[(2s,3s)-3-[[(2s)-1-[[2-[(2-methoxy-2-oxo-ethyl)amino]-2-oxo-ethyl]amino]-4-methyl-1-oxo-pentan-2-yl]carbamoyl]oxiran-2-yl]carbonylamino]-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-2-[[(2s,3s)-3-[[(2s)-1-[[2-[(2-methoxy-2-oxoethyl)amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carbonyl]amino]-4-methylpentanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-2-[[[(2s,3s)-3-[[[(1s)-1-[[[2-[(2-methoxy-2-oxoethyl)amino]-2-oxoethyl]amino]-oxomethyl]-3-methylbutyl]amino]-oxomethyl]-2-oxiranyl]-oxomethyl]amino]-4-methyl-1-oxopentyl]-2-pyrrolidinecarboxylic acid
InChIKey LLLKOFOBLVPXQZ-RNEDXHKXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N