CYW

S-[(2R)-2-hydroxypropanoyl]-L-cysteine

Created: 2011-02-16
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count23
Chiral Atom Count2
Bond Count22
Aromatic Bond Count0
2D diagram of CYW

Chemical Component Summary

NameS-[(2R)-2-hydroxypropanoyl]-L-cysteine
Synonymslactoylglutathione
Systematic Name (OpenEye OEToolkits)(2R)-2-azanyl-3-[(2R)-2-hydroxypropanoyl]sulfanyl-propanoic acid
FormulaC6 H11 N O4 S
Molecular Weight193.221
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(SCC(C(=O)O)N)C(O)C
SMILESCACTVS3.370C[CH](O)C(=O)SC[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.7.0CC(C(=O)SCC(C(=O)O)N)O
Canonical SMILESCACTVS3.370 C[C@@H](O)C(=O)SC[C@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.0 C[C@H](C(=O)SC[C@@H](C(=O)O)N)O
InChIInChI1.03 InChI=1S/C6H11NO4S/c1-3(8)6(11)12-2-4(7)5(9)10/h3-4,8H,2,7H2,1H3,(H,9,10)/t3-,4+/m1/s1
InChIKeyInChI1.03 SRTPBDVCLYHKFK-DMTCNVIQSA-N

Related Resource References

Resource NameReference
PubChem 137349142