N-[(2S,3R)-3-Amino-2-Hydroxy-4-Phenylbutanoyl]-L-Leucyl-L-Prolyl-L-Proline

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Properties Simple | Detailed

Formula C26H38N4O6
IUPAC Name (2s)-1-[(2s)-1-[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Molecular Mass 502.603 g·mol−1
Heat of Formation -1140.5 ± 16.7 kJ·mol−1
Dipole Moment 3.74 ± 1.08 D
Volume 628.24 Å 3
Surface Area 512.37 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 3.38 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1-[(2s)-1-[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-pentanoyl]pyrrolidin-2-yl]carbonylpyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-1-[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]proline
  • (2s)-1-[(2s)-1-[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(2s)-1-[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[[(2s)-1-[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-1-oxo-4-phenylbutyl]amino]-4-methyl-1-oxopentyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid
  • 1-(1-(n-(3-amino-2-hydroxy-1-oxo-4-phenylbutyl)leucyl)prolyl)proline
  • probestin
  • proline, 1-(1-(n-(3-amino-2-hydroxy-1-oxo-4-phenylbutyl)leucyl)prolyl)-
CAS Number(s)
  • 123652-87-9
InChIKey CEQMEILRVSCKGT-FXTUREPZSA-N
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