BioLiP

PDB

BioLiP

PDB CCD ID:

A1LWI

Number of entries in BioLiP:

Chemical formula:

C19 H12 N2 O

InChI:

InChI=1S/C19H12N2O/c22-10-14-18-12-6-2-4-8-16(12)20-17(18)9-13-11-5-1-3-7-15(11)21-19(13)14/h1-10,20-21H

InChIKey:

ZUDXFBWDXVNRKF-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc2c(c1)c3cc4c(c5ccccc5[nH]4)c(c3[nH]2)C=O
CACTVS 3.385	O=Cc1c2[nH]c3ccccc3c2cc4[nH]c5ccccc5c14

Name:

5,11-dihydroindolo[3,2-b]carbazole-12-carbaldehyde

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).