Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

GT9

Summary
Name:S-NONYL-CYSTEINE
Formula:C12 H25 N O2 S
Formal charge:0
Formula weight:247.397 Da
Component type:L-PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.04S-nonyl-L-cysteine
OpenEye OEToolkits1.5.0(2R)-2-amino-3-nonylsulfanyl-propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)C(N)CSCCCCCCCCC
SMILES_CANONICALCACTVS3.341CCCCCCCCCSC[C@H](N)C(O)=O
SMILESCACTVS3.341CCCCCCCCCSC[CH](N)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCCCCCSC[C@@H](C(=O)O)N
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCSCC(C(=O)O)N
InChIInChI1.03InChI=1S/C12H25NO2S/c1-2-3-4-5-6-7-8-9-16-10-11(13)12(14)15/h11H,2-10,13H2,1H3,(H,14,15)/t11-/m0/s1
InChIKeyInChI1.03NYQGIUKEPYHDNY-NSHDSACASA-N

219140

PDB entries from 2024-05-01

PDB statisticsPDBj update infoContact PDBjnumon