BioLiP

PDB

BioLiP

PDB CCD ID:

L6Y

Number of entries in BioLiP:

Chemical formula:

C19 H11 N O4

InChI:

InChI=1S/C19H11NO4/c21-17(11-5-2-1-3-6-11)13-9-10-15-16-12(13)7-4-8-14(16)18(22)20(24)19(15)23/h1-10,24H

InChIKey:

AFGMHSZWGJYWFH-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	ON1C(=O)c2cccc3c(ccc(C1=O)c23)C(=O)c4ccccc4
OpenEye OEToolkits 1.9.2	c1ccc(cc1)C(=O)c2ccc3c4c2cccc4C(=O)N(C3=O)O

Name:

2-oxidanyl-6-(phenylcarbonyl)benzo[de]isoquinoline-1,3-dione

ZINC:

ZINC000005234386

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).