BioLiP

PDB

BioLiP

PDB CCD ID:

A1BA1

Number of entries in BioLiP:

Chemical formula:

C9 H10 N2 O3

InChI:

InChI=1S/C9H10N2O3/c1-14-9(13)10-11(7-12)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,13)

InChIKey:

ONYPTZRFIFAKIZ-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 2.0.7	COC(=O)NN(C=O)c1ccccc1
ACDLabs 14.52	O=C(NN(C=O)c1ccccc1)OC

Name:

methyl 2-formyl-2-phenylhydrazine-1-carboxylate

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).