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BioLiP

PDB CCD ID: UDI
Number of entries in BioLiP: 1
Chemical formula: C4 H10 S2
InChI: InChI=1S/C4H10S2/c5-3-1-2-4-6/h5-6H,1-4H2
InChIKey: SMTOKHQOVJRXLK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385SCCCCS
OpenEye OEToolkits 2.0.7C(CCS)CS
Name:butane-1,4-dithiol;
1,2-dithiane 1-oxide (reacted)
ZINC: ZINC000003860245
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).
  • 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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