SEQ2FUN

BioLiP

PDB CCD ID: ULI
Number of entries in BioLiP: 0
Chemical formula: C40 H82
InChI: InChI=1S/C40H82/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3
InChIKey: KUPLEGDPSCCPJI-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370
OpenEye OEToolkits 1.7.2		CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
ACDLabs 12.01C(CCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC
Name:tetracontane;
n-Tetracontane
ZINC: ZINC000006921185
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).