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Summary
Name:(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid
Synonyms:S-(2-hydroxyethyl)-D-cysteine
Formula:C5 H11 N O3 S
Formal charge:0
Formula weight:165.211 Da
Component type:L-peptide linking

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S})-2-azanyl-3-(2-hydroxyethylsulfanyl)propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C5H11NO3S/c6-4(5(8)9)3-10-2-1-7/h4,7H,1-3,6H2,(H,8,9)/t4-/m1/s1
InChIKeyInChI1.03MWFRVMDVLYIXJF-SCSAIBSYSA-N
SMILES_CANONICALCACTVS3.385N[C@H](CSCCO)C(O)=O
SMILESCACTVS3.385N[CH](CSCCO)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C(CSC[C@H](C(=O)O)N)O
SMILESOpenEye OEToolkits2.0.7C(CSCC(C(=O)O)N)O

224931

PDB entries from 2024-09-11

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