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BioLiP

PDB CCD ID: 17Y
Number of entries in BioLiP: 1
Chemical formula: C5 H10 O2
InChI: InChI=1S/C5H10O2/c6-4-2-1-3-5(4)7/h4-7H,1-3H2/t4-,5+
InChIKey: VCVOSERVUCJNPR-SYDPRGILSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370O[CH]1CCC[CH]1O
OpenEye OEToolkits 1.7.6C1CC(C(C1)O)O
OpenEye OEToolkits 1.7.6C1C[C@H]([C@H](C1)O)O
CACTVS 3.370O[C@H]1CCC[C@H]1O
ACDLabs 12.01OC1CCCC1O
Name:(1R,2S)-cyclopentane-1,2-diol
ChEMBL: CHEMBL399324
ZINC: ZINC000012363441
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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