Anserine

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Properties Simple | Detailed

Formula C10H18N4O3+
IUPAC Name (2s)-2-(3-azaniumylpropanoylamino)-3-(3-methylimidazol-1-ium-4-id-4-yl)propanoate
Molecular Mass 242.275 g·mol−1
Heat of Formation -468.8 ± 16.7 kJ·mol−1
Dipole Moment 3.71 ± 1.08 D
Volume 292.76 Å 3
Surface Area 260.13 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy 0.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(3-aminopropanoylamino)-3-(3-methylimidazol-4-yl)propanoic acid
  • (2s)-2-(3-aminopropanoylamino)-3-(3-methylimidazol-4-yl)propionic acid
  • (2s)-2-[(3-amino-1-oxopropyl)amino]-3-(3-methyl-4-imidazolyl)propanoic acid
  • beta-alanyl-3-methyl-l-histidine
  • beta-alanyl-n(pai)-methyl-l-histidine
  • beta-alanyl-n(pi)-methyl-l-histidine
  • n(alpha)-(beta-alanyl)-n(pros)-methylhistidine
CAS Number(s)
  • 584-85-0
InChIKey MYYIAHXIVFADCU-QMMMGPOBSA-N
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