N~5~-(Diaminomethylene)-L-Ornithyl-L-Valyl-L-Glutamic Acid

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Properties Simple | Detailed

Formula C16H30N6O6
IUPAC Name (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]pentanedioic acid
Molecular Mass 402.446 g·mol−1
Heat of Formation -1236.6 ± 16.7 kJ·mol−1
Dipole Moment 4.60 ± 1.08 D
Volume 504.25 Å 3
Surface Area 387.25 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 0.72 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methyl-butanoyl]amino]pentanedioic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]pentanedioic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-1-oxopentyl]amino]-3-methyl-1-oxobutyl]amino]pentanedioic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]glutaric acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-5-guanidino-pentanoyl]amino]-3-methyl-butanoyl]amino]pentanedioic acid
  • l-glutamic acid, n-(n-l-arginyl-l-valyl)-
  • msh, beta, (6-8)
CAS Number(s)
  • 85775-46-8
InChIKey ULBHWNVWSCJLCO-NHCYSSNCSA-N
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