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BioLiP

PDB CCD ID: P03
Number of entries in BioLiP: 2
Chemical formula: C10 H22 O5
InChI: InChI=1S/C10H22O5/c11-3-9-14-7-1-5-13-6-2-8-15-10-4-12/h11-12H,1-10H2
InChIKey: GNAZJSIZGCDIQL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.352OCCOCCCOCCCOCCO
OpenEye OEToolkits 1.7.0C(COCCCOCCO)COCCO
Name:2-[3-[3-(2-hydroxyethoxy)propoxy]propoxy]ethanol
ZINC: ZINC000058633634
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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