BioLiP

PDB

BioLiP

PDB CCD ID:

UCU

Number of entries in BioLiP:

Chemical formula:

C4 H8 O3

InChI:

InChI=1S/C4H8O3/c1-2-3(5)4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1

InChIKey:

AFENDNXGAFYKQO-GSVOUGTGSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	CC[C@H](C(=O)O)O
CACTVS 3.385	CC[CH](O)C(O)=O
CACTVS 3.385	CC[C@@H](O)C(O)=O
OpenEye OEToolkits 2.0.7	CCC(C(=O)O)O

Name:

(2R)-2-oxidanylbutanoic acid;
(R)-2-Hydroxybutanoic acid

ZINC:

ZINC000001693559

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).