Formula |
C12H18ClN3O7S |
IUPAC Name |
(2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[(2-chloroacetyl)sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid |
Molecular Mass |
383.805 g·mol−1 |
Heat of Formation |
-1307.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.73 ± 1.08 D |
Volume |
419.1 Å 3 |
Surface Area |
375.87 Å 2 |
HOMO Energy |
-9.67 ± 0.55 eV |
LUMO Energy |
-1.05 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[(2-chloroacetyl)sulfanylmethyl]-2-oxo-ethyl]amino]-5-oxo-pentanoic acid
- (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(2-chloro-1-oxoethyl)thio]methyl]-2-oxoethyl]amino]-5-oxopentanoic acid
- (2s)-2-amino-5-[[(1r)-2-(carboxymethylamino)-1-[[(2-chloroacetyl)thio]methyl]-2-keto-ethyl]amino]-5-keto-valeric acid
- (2s)-2-amino-5-[[(2r)-1-(carboxymethylamino)-3-(2-chloroethanoylsulfanyl)-1-oxo-propan-2-yl]amino]-5-oxo-pentanoic acid
- 2-chloroacetylglutathione
- clch2cosg
- glycine, n-(s-(chloroacetyl)-n-l-gamma-glutamyl-l-cysteinyl)-
- s-(2-chloroacetyl)glutathione
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CAS Number(s) |
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InChIKey |
QJDRMMRBPVHMAD-BQBZGAKWSA-N |
QR Code |
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Links |
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DOI |
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Elements |
C
Cl
H
O
N
S
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