L-Phenylalanyl-L-Prolyl-N~5~-(Diaminomethylene)-L-Ornithine

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Properties Simple | Detailed

Formula C20H30N6O4
IUPAC Name (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-guanidino-pentanoic acid
Molecular Mass 418.490 g·mol−1
Heat of Formation -686.8 ± 16.7 kJ·mol−1
Dipole Moment 2.16 ± 1.08 D
Volume 506.4 Å 3
Surface Area 383.9 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy 0.22 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidin-2-yl]carbonylamino]-5-(diaminomethylideneamino)pentanoic acid
  • (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-guanidino-pentanoic acid
  • (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]-5-guanidino-valeric acid
  • (2s)-2-[[(2s)-1-[(2s)-2-amino-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-5-(diaminomethylideneamino)pentanoic acid
  • (2s)-2-[[[(2s)-1-[(2s)-2-amino-1-oxo-3-phenylpropyl]-2-pyrrolidinyl]-oxomethyl]amino]-5-guanidinopentanoic acid
InChIKey NTUPOKHATNSWCY-JYJNAYRXSA-N
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