(2S)-2-Amino-3-{[(2E)-4-Methoxy-4-Oxo-2-Butenoyl]Amino}Propanoyl L-Norvalinate

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Properties Simple | Detailed

Formula C13H21N3O6
IUPAC Name [(2s)-2-amino-3-[[(e)-4-methoxy-4-oxo-but-2-enoyl]amino]propanoyl] (2s)-2-aminopentanoate
Molecular Mass 315.322 g·mol−1
Heat of Formation -1058.5 ± 16.7 kJ·mol−1
Dipole Moment 1.13 ± 1.08 D
Volume 379.0 Å 3
Surface Area 324.11 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-aminopentanoic acid [(2s)-2-amino-3-[[(e)-4-methoxy-1,4-dioxobut-2-enyl]amino]-1-oxopropyl] ester
  • (2s)-2-aminovaleric acid [(2s)-2-amino-3-[[(e)-4-keto-4-methoxy-but-2-enoyl]amino]propanoyl] ester
  • [(2s)-2-amino-3-[[(e)-4-methoxy-4-oxo-but-2-enoyl]amino]propanoyl] (2s)-2-aminopentanoate
  • [(2s)-2-amino-3-[[(e)-4-methoxy-4-oxobut-2-enoyl]amino]propanoyl] (2s)-2-aminopentanoate
  • l-alanine, 3-((4-methoxy-1,4-dioxo-2-butenyl)amino)-n-l-norvalyl-, (e)-
  • norvalyl-n(3)-(4-methoxyfumaroyl)-2,3-diaminopropionic acid
  • nva-fmdp
CAS Number(s)
  • 108340-69-8
InChIKey UIRYEXFXYYEJGD-MUNZNRDXSA-N
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