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BioLiP

PDB CCD ID: 1Y8
Number of entries in BioLiP: 5
Chemical formula: C5 H14 As O
InChI: InChI=1S/C5H15AsO/c1-6(2,3)4-5-7/h6-7H,4-5H2,1-3H3
InChIKey: CIHXLIBMYUSRLN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01OCC[As](C)(C)C
CACTVS 3.385
OpenEye OEToolkits 1.7.6		C[As](C)(C)CCO
Name:2-(trimethyl-lambda~5~-arsanyl)ethanol
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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