BioLiP

PDB

BioLiP

PDB CCD ID:

HA4

Number of entries in BioLiP:

Chemical formula:

C18 H34 O2

InChI:

InChI=1S/C18H34O2/c19-18(20)16-17-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17/h17H,1-16H2,(H,19,20)

InChIKey:

IFTPBTVIWNNVAJ-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C1CCCCCCCC(CCCCCCC1)CC(=O)O
CACTVS 3.385	OC(=O)CC1CCCCCCCCCCCCCCC1

Name:

2-cyclohexadecylethanoic acid;
2-cyclohexadecylacetic acid

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).