BioLiP

PDB

BioLiP

PDB CCD ID:

FYU

Number of entries in BioLiP:

Chemical formula:

C5 H4 N2 O3

InChI:

InChI=1S/C5H4N2O3/c8-2-3-1-6-5(10)7-4(3)9/h1-2H,(H2,6,7,9,10)

InChIKey:

OHAMXGZMZZWRCA-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01	N1C(NC(C(=C1)C=O)=O)=O
CACTVS 3.385	O=CC1=CNC(=O)NC1=O
OpenEye OEToolkits 1.9.2	C1=C(C(=O)NC(=O)N1)C=O

Name:

2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbaldehyde;
5-formyluracil

ZINC:

ZINC000000434270

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).