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BioLiP Library

PDB CCD ID: 06C
Number of entries in BioLiP: 1
Chemical formula: C H3 I
InChI: InChI=1S/CH3I/c1-2/h1H3
InChIKey: INQOMBQAUSQDDS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01IC
CACTVS 3.370
OpenEye OEToolkits 1.7.0		CI
Name:Iodomethane;
Methyl iodine
ChEMBL: CHEMBL115849
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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