BioLiP

PDB

BioLiP

PDB CCD ID:

A1CWV

Number of entries in BioLiP:

Chemical formula:

C8 H12 N2 O2

InChI:

InChI=1S/C8H12N2O2/c11-6-8(10-7(12)9-6)4-2-1-3-5-8/h1-5H2,(H2,9,10,11,12)

InChIKey:

NERNEXMEYQFFHU-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 3.1.0.0	C1CCC2(CC1)C(=O)NC(=O)N2
ACDLabs 14.52	O=C1NC(=O)NC21CCCCC2
CACTVS 3.385	O=C1NC(=O)C2(CCCCC2)N1

Name:

1,3-diazaspiro[4.5]decane-2,4-dione

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).