L-Asparaginylglycyl-N-(Butoxycarbonyl)Glycinamide

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Properties Simple | Detailed

Formula C13H23N5O6
IUPAC Name butyl n-[2-[[2-[[(2s)-2,4-diamino-4-oxo-butanoyl]amino]acetyl]amino]acetyl]carbamate
Molecular Mass 345.352 g·mol−1
Heat of Formation -1162.4 ± 16.7 kJ·mol−1
Dipole Moment 5.80 ± 1.08 D
Volume 410.45 Å 3
Surface Area 388.49 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 0.20 ± eV
Point Group Symmetry C1
Synonyms
  • boc-l-asn-gly-gly-nh2
  • butyl n-[2-[2-[[(2s)-2,4-diamino-4-oxo-butanoyl]amino]ethanoylamino]ethanoyl]carbamate
  • butyl n-[2-[[2-[[(2s)-2,4-diamino-4-oxo-butanoyl]amino]acetyl]amino]acetyl]carbamate
  • butyl n-[2-[[2-[[(2s)-2,4-diamino-4-oxobutanoyl]amino]acetyl]amino]acetyl]carbamate
  • butyloxycarbonyl-asparaginyl-glycyl-glycinamide
  • n-[2-[[2-[[(2s)-2,4-diamino-1,4-dioxobutyl]amino]-1-oxoethyl]amino]-1-oxoethyl]carbamic acid butyl ester
  • n-[2-[[2-[[(2s)-2,4-diamino-4-keto-butanoyl]amino]acetyl]amino]acetyl]carbamic acid butyl ester
CAS Number(s)
  • 123472-61-7
InChIKey GNURUUOBIIVPEH-QMMMGPOBSA-N
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