BioLiP

PDB

BioLiP

PDB CCD ID:

A1EOP

Number of entries in BioLiP:

Chemical formula:

C4 H6 O3

InChI:

InChI=1S/C4H6O3/c5-3-1-4(6)7-2-3/h3,5H,1-2H2/t3-/m1/s1

InChIKey:

FUDDLSHBRSNCBV-GSVOUGTGSA-N

SMILES:

Software	SMILES
CACTVS 3.385	O[CH]1COC(=O)C1
OpenEye OEToolkits 2.0.7	C1[C@H](COC1=O)O
CACTVS 3.385	O[C@H]1COC(=O)C1
OpenEye OEToolkits 2.0.7	C1C(COC1=O)O

Name:

(4~{R})-4-oxidanyloxolan-2-one

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).