(2S)-2-({N-[(2S)-2-Ammonio-3-Methylbutanoyl]-L-Valyl}Amino)-3-Methylbutanoate

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Properties Simple | Detailed

Formula C15H29N3O4
IUPAC Name (2s)-2-[[(2s)-2-[[(2s)-2-amino-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoic acid
Molecular Mass 315.408 g·mol−1
Heat of Formation -965.3 ± 16.7 kJ·mol−1
Dipole Moment 2.55 ± 1.08 D
Volume 421.97 Å 3
Surface Area 338.25 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy 0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]-3-methylbutanoic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoic acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butyric acid
  • (2s)-2-[[(2s)-2-[[(2s)-2-amino-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoic acid
InChIKey LSLXWOCIIFUZCQ-SRVKXCTJSA-N
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