S-Hydroxymethylglutathione

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Properties Simple | Detailed

Formula C11H19N3O7S
IUPAC Name (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-(hydroxymethylsulfanylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 337.349 g·mol−1
Heat of Formation -1287.2 ± 16.7 kJ·mol−1
Dipole Moment 1.37 ± 1.08 D
Volume 383.4 Å 3
Surface Area 343.29 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -0.27 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-(hydroxymethylsulfanylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[(hydroxymethylthio)methyl]-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-2-keto-1-[(methylolthio)methyl]ethyl]amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(2r)-1-(carboxymethylamino)-3-(hydroxymethylsulfanyl)-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • 2-amino-4-[1-carboxymethyl-carbamoyl)-2-hydroxymethylsulfanyl-ethylcarbamoyl]-butyric acid
  • ahe
  • s-(hydroxymethyl)glutathione
  • s-hydroxymethyl glutathione
CAS Number(s)
  • 32260-87-0
InChIKey PIUSLWSYOYFRFR-BQBZGAKWSA-N
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