BioLiP

PDB

BioLiP

PDB CCD ID:

VBQ

Number of entries in BioLiP:

Chemical formula:

C16 H11 N O4

InChI:

InChI=1S/C16H11NO4/c18-13(19)8-17-16(21)12-7-3-6-11-14(12)9-4-1-2-5-10(9)15(11)20/h1-7H,8H2,(H,17,21)(H,18,19)

InChIKey:

XIDITRUNIYHCDR-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc2c(c1)-c3c(cccc3C(=O)NCC(=O)O)C2=O
CACTVS 3.385	OC(=O)CNC(=O)c1cccc2C(=O)c3ccccc3c12

Name:

2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]ethanoic acid

ChEMBL:

CHEMBL5218656

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).