SCY

S-ACETYL-CYSTEINE

Created: 1999-07-08
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count19
Chiral Atom Count1
Bond Count18
Aromatic Bond Count0
2D diagram of SCY
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Chemical Component Summary

NameS-ACETYL-CYSTEINE
Systematic Name (OpenEye OEToolkits)(2R)-2-amino-3-ethanoylsulfanyl-propanoic acid
FormulaC5 H9 N O3 S
Molecular Weight163.195
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)C(N)CSC(=O)C
SMILESCACTVS3.341CC(=O)SC[CH](N)C(O)=O
SMILESOpenEye OEToolkits1.5.0CC(=O)SCC(C(=O)O)N
Canonical SMILESCACTVS3.341 CC(=O)SC[C@H](N)C(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 CC(=O)SC[C@@H](C(=O)O)N
InChIInChI1.03 InChI=1S/C5H9NO3S/c1-3(7)10-2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9)/t4-/m0/s1
InChIKeyInChI1.03 XCIRMLHOFVDUDP-BYPYZUCNSA-N

Drug Info: DrugBank

DrugBank IDDB02039 
NameS-Acetyl-Cysteine
Groups experimental
SynonymsS-Acetyl-Cysteine

Drug Targets

NameTarget SequencePharmacological ActionActions
Histone acetyltransferase KAT5MAEVGEIIEGCRLPVLRRNQDNEDEWPLAEILSVKDISGRKLFYVHYIDF...unknown
Acetyl-CoA acetyltransferaseMSTPSIVIASARTAVGSFNGAFANTPAHELGATVISAVLERAGVAAGEVN...unknown
3-oxoacyl-[acyl-carrier-protein] synthase 3MYTKIIGTGSYLPEQVRTNADLEKMVDTSDEWIVTRTGIRERHIAAPNET...unknown
3-hydroxy-3-methylglutaryl CoA synthaseMTIGIDKINFYVPKYYVDMAKLAEARQVDPNKFLIGIGQTEMAVSPVNQD...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 86310571, 10130120