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BioLiP

PDB CCD ID: 3ZS
Number of entries in BioLiP: 8
Chemical formula: C5 H8 O
InChI: InChI=1S/C5H8O/c1-2-4-5(3-1)6-4/h4-5H,1-3H2/t4-,5+
InChIKey: GJEZBVHHZQAEDB-SYDPRGILSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2C1C[C@@H]2[C@H](C1)O2
ACDLabs 12.01O1C2CCCC12
OpenEye OEToolkits 1.9.2C1CC2C(C1)O2
CACTVS 3.385C1C[CH]2O[CH]2C1
CACTVS 3.385C1C[C@@H]2O[C@@H]2C1
Name:(1R,5S)-6-oxabicyclo[3.1.0]hexane
ZINC: ZINC000001639894
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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