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BioLiP

PDB CCD ID: KCS
Number of entries in BioLiP: 1
Chemical formula: C H2 S3
InChI: InChI=1S/CH2S3/c2-1(3)4/h(H2,2,3,4)
InChIKey: HIZCIEIDIFGZSS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(=S)(S)S
ACDLabs 11.02S=C(S)S
CACTVS 3.352SC(S)=S
Name:carbonotrithioic acid;
Trithiocarbonic acid
ChEMBL: CHEMBL1207991
ZINC: ZINC000044418363
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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