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BioLiP

PDB CCD ID: SAT
Number of entries in BioLiP: 3
Chemical formula: C2 H4 O5 S
InChI: InChI=1S/C2H4O5S/c3-2(4)1-8(5,6)7/h1H2,(H,3,4)(H,5,6,7)
InChIKey: AGGIJOLULBJGTQ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341OC(=O)C[S](O)(=O)=O
ACDLabs 10.04O=C(O)CS(=O)(=O)O
OpenEye OEToolkits 1.5.0C(C(=O)O)S(=O)(=O)O
Name:sulfoacetic acid
ZINC: ZINC000004429660
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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