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BioLiP

PDB CCD ID: PYE
Number of entries in BioLiP: 1
Chemical formula: C5 H10 O
InChI: InChI=1S/C5H10O/c1-2-4-6-5-3-1/h1-5H2
InChIKey: DHXVGJBLRPWPCS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0		C1CCOCC1
ACDLabs 10.04O1CCCCC1
Name:TETRAHYDROPYRAN
DrugBank: DB02412
ZINC: ZINC000001692451
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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