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BioLiP Library

PDB CCD ID: C5C
Number of entries in BioLiP: 0
Chemical formula: C8 H15 N O2 S2
InChI: InChI=1S/C8H15NO2S2/c9-7(8(10)11)5-12-13-6-3-1-2-4-6/h6-7H,1-5,9H2,(H,10,11)/t7-/m0/s1
InChIKey: YZTTYCHSXMGEER-ZETCQYMHSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1CCC(C1)SSC[C@@H](C(=O)O)N
ACDLabs 10.04O=C(O)C(N)CSSC1CCCC1
CACTVS 3.341N[C@@H](CSSC1CCCC1)C(O)=O
OpenEye OEToolkits 1.5.0C1CCC(C1)SSCC(C(=O)O)N
CACTVS 3.341N[CH](CSSC1CCCC1)C(O)=O
Name:S-CYCLOPENTYL THIOCYSTEINE
ZINC: ZINC000033622264
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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