SEQ2FUN

BioLiP

PDB CCD ID: DFD
Number of entries in BioLiP: 6
Chemical formula: C11 H22 O2
InChI: InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-13-11-12/h11H,2-10H2,1H3
InChIKey: BCLJZFLDSCTULJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0		CCCCCCCCCCOC=O
ACDLabs 10.04O=COCCCCCCCCCC
Name:DECYL FORMATE
DrugBank: DB07650
ZINC: ZINC000001583950
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).