BioLiP

PDB

BioLiP

PDB CCD ID:

A1IZL

Number of entries in BioLiP:

Chemical formula:

C5 H10 O5

InChI:

InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2/t3-,4-,5+/m1/s1

InChIKey:

LQXVFWRQNMEDEE-WDCZJNDASA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C1[C@H]([C@H]([C@@](O1)(CO)O)O)O
OpenEye OEToolkits 2.0.7	C1C(C(C(O1)(CO)O)O)O
CACTVS 3.385	OC[C]1(O)OC[CH](O)[CH]1O
CACTVS 3.385	OC[C@]1(O)OC[C@@H](O)[C@H]1O

Name:

(2~{S},3~{R},4~{R})-2-(hydroxymethyl)oxolane-2,3,4-triol

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).