L-Prolyl-N-{(2S)-5-[(Diaminomethylene)Amino]-2-[(4-Methyl-2-Oxo-2H-Chromen-7-Yl)Amino]Pentanoyl}-L-Phenylalaninamide

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Properties Simple | Detailed

Formula C30H38N7O5+
IUPAC Name (2s)-n-[(1s)-1-benzyl-2-[[(2s)-5-guanidino-2-[(4-methyl-2-oxo-chromen-7-yl)amino]pentanoyl]amino]-2-oxo-ethyl]pyrrolidine-2-carboxamide
Molecular Mass 576.667 g·mol−1
Heat of Formation -624.3 ± 16.7 kJ·mol−1
Dipole Moment 8.15 ± 1.08 D
Volume 698.66 Å 3
Surface Area 577.86 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(1s)-1-(benzyl)-2-[[(2s)-5-guanidino-2-[(2-keto-4-methyl-chromen-7-yl)amino]pentanoyl]amino]-2-keto-ethyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(1s)-2-[[(2s)-5-guanidino-2-[(4-methyl-2-oxo-7-chromenyl)amino]-1-oxopentyl]amino]-2-oxo-1-(phenylmethyl)ethyl]-2-pyrrolidinecarboxamide
  • (2s)-n-[(1s)-2-[[(2s)-5-guanidino-2-[(4-methyl-2-oxo-chromen-7-yl)amino]pentanoyl]amino]-2-oxo-1-(phenylmethyl)ethyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-1-[[(2s)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxo-chromen-7-yl)amino]pentanoyl]amino]-1-oxo-3-phenyl-propan-2-yl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-1-[[(2s)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxochromen-7-yl)amino]pentanoyl]amino]-1-oxo-3-phenylpropan-2-yl]pyrrolidine-2-carboxamide
  • l-argininamide, l-prolyl-l-phenylalanyl-n-(4-methyl-2-oxo-2h-1-benzopyran-7-yl)-
  • pro-phe-arg-mca
  • prolyl-phenylalanyl-arginine-4-methylcoumaryl-7-amide
CAS Number(s)
  • 65147-21-9
InChIKey URNKXHHGSVKUKV-HJOGWXRNSA-N
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