L-γ-Glutamyl-S-{(S)-Hydroxy[Hydroxy(4-Iodophenyl)Amino]Methyl}-D-Cysteinylglycine

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Properties Simple | Detailed

Formula C17H23IN4O8S+
IUPAC Name (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(r)-hydroxy-(n-hydroxy-4-iodo-anilino)methyl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 570.356 g·mol−1
Heat of Formation -1241.2 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 545.78 Å 3
Surface Area 456.43 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
InChIKey SCHAHXXLASZJCD-NVGCLXPQSA-N
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