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BioLiP Library

PDB CCD ID: CSW
Number of entries in BioLiP: 0
Chemical formula: C3 H7 N O4 S
InChI: InChI=1S/C3H7NO4S/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)(H,7,8)/t2-/m0/s1
InChIKey: ADVPTQAUNPRNPO-REOHCLBHSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6C([C@@H](C(=O)O)N)S(=O)O
ACDLabs 12.01O=C(O)C(N)CS(=O)O
CACTVS 3.385N[C@@H](C[S](O)=O)C(O)=O
OpenEye OEToolkits 1.7.6C(C(C(=O)O)N)S(=O)O
CACTVS 3.385N[CH](C[S](O)=O)C(O)=O
Name:CYSTEINE-S-DIOXIDE;
CYSTEINE SULFINIC ACID
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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