BioLiP

PDB

BioLiP

PDB CCD ID:

AXO

Number of entries in BioLiP:

Chemical formula:

C2 H5 N O

InChI:

InChI=1S/C2H5NO/c1-2-3-4/h2,4H,1H3/b3-2+

InChIKey:

FZENGILVLUJGJX-NSCUHMNNSA-N

SMILES:

Software	SMILES
CACTVS 3.385 OpenEye OEToolkits 1.7.6	C/C=N/O
CACTVS 3.385 OpenEye OEToolkits 1.7.6	CC=NO
ACDLabs 12.01	N(/O)=C\C

Name:

(1E)-N-hydroxyethanimine;
Acetaldoxime

ZINC:

ZINC000100006104

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).