SEQ2FUN

BioLiP

PDB CCD ID: 6VV
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-/m1/s1
InChIKey: VCVOSERVUCJNPR-RFZPGFLSSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385O[CH]1CCC[CH]1O
OpenEye OEToolkits 2.0.5C1CC(C(C1)O)O
CACTVS 3.385O[C@@H]1CCC[C@H]1O
OpenEye OEToolkits 2.0.5C1C[C@H]([C@@H](C1)O)O
Name:(1~{R},2~{R})-cyclopentane-1,2-diol
ZINC: ZINC000000388466
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).