Golotimod

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Properties Simple | Detailed

Formula C16H19N3O5
IUPAC Name (2r)-2-amino-5-[[(1s)-1-carboxy-2-indol-1-ium-3-yl-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 333.339 g·mol−1
Heat of Formation -827.8 ± 16.7 kJ·mol−1
Dipole Moment 4.76 ± 1.08 D
Volume 392.28 Å 3
Surface Area 328.21 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-amino-5-[[(1s)-2-hydroxy-1-(1h-indol-3-ylmethyl)-2-keto-ethyl]amino]-5-keto-valeric acid
  • (2r)-2-amino-5-[[(1s)-2-hydroxy-1-(1h-indol-3-ylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2r)-2-amino-5-[[(1s)-2-hydroxy-1-(1h-indol-3-ylmethyl)-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2r)-2-amino-5-[[(2s)-1-hydroxy-3-(1h-indol-3-yl)-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • (2r)-2-amino-5-[[(2s)-1-hydroxy-3-(1h-indol-3-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
  • gamma-d-glu-l-trp
  • scv07
CAS Number(s)
  • 229305-39-9
InChIKey CATMPQFFVNKDEY-YPMHNXCESA-N
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