BioLiP

PDB

BioLiP

PDB CCD ID:

6LW

Number of entries in BioLiP:

Chemical formula:

C5 H9 N O5

InChI:

InChI=1S/C5H9NO5/c7-1-2-3(8)4(9)5(6-10)11-2/h2-4,7-10H,1H2/b6-5-/t2-,3-,4+/m0/s1

InChIKey:

AVHYWFZJLLOYOD-XXXIWBGBSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.6	C([C@H]1[C@@H]([C@H](/C(=N/O)/O1)O)O)O
OpenEye OEToolkits 2.0.6	C(C1C(C(C(=NO)O1)O)O)O
CACTVS 3.385	OC[CH]1OC(=NO)[CH](O)[CH]1O
CACTVS 3.385	OC[C@@H]1OC(=N\O)/[C@H](O)[C@H]1O

Name:

(Z)-L-Arabinonhydroximo-1,4-lactone;
(2~{Z},3~{R},4~{R},5~{S})-2-hydroxyimino-5-(hydroxymethyl)oxolane-3,4-diol

ChEMBL:

CHEMBL5177392

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).