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BioLiP Library

PDB CCD ID: MPR
Number of entries in BioLiP: 2
Chemical formula: C3 H6 O S
InChI: InChI=1S/C3H6OS/c4-2-1-3-5/h2,5H,1,3H2
InChIKey: BMYLOHDOJPEVOR-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341SCCC=O
OpenEye OEToolkits 1.5.0C(CS)C=O
ACDLabs 10.04O=CCCS
Name:2-MERCAPTO-PROPION ALDEHYDE
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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