L-γ-Glutamyl-S-[(9R,10R)-10-Hydroxy-9,10-Dihydro-9-Phenanthrenyl]-L-Cysteinylglycine

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Properties Simple | Detailed

Formula C24H27N3O7S
IUPAC Name (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(9r,10r)-10-hydroxy-9,10-dihydrophenanthren-9-yl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 501.552 g·mol−1
Heat of Formation -1142.0 ± 16.7 kJ·mol−1
Dipole Moment 5.46 ± 1.08 D
Volume 578.21 Å 3
Surface Area 480.83 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(9r,10r)-10-hydroxy-9,10-dihydrophenanthren-9-yl]sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[[(9r,10r)-10-hydroxy-9,10-dihydrophenanthren-9-yl]thio]methyl]-2-keto-ethyl]amino]-5-keto-valeric acid
  • (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[[(9r,10r)-10-hydroxy-9,10-dihydrophenanthren-9-yl]thio]methyl]-2-oxoethyl]amino]-5-oxopentanoic acid
  • (2s)-2-amino-5-[[(2r)-1-(carboxymethylamino)-3-[[(9r,10r)-10-hydroxy-9,10-dihydrophenanthren-9-yl]sulfanyl]-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
  • (2s)-2-amino-5-[[(2r)-1-(carboxymethylamino)-3-[[(9r,10r)-10-hydroxy-9,10-dihydrophenanthren-9-yl]sulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
  • (9r,10r)-9-(s-glutathionyl)-10-hydroxy-9,10-dihydrophenanthrene
  • 9r,10r-9-glutathionyl-10-hydroxy-9,10-dihydro phenanthrene
  • gpr
InChIKey JNNIZILNBMPOAC-MOXQZVSFSA-N
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