BioLiP

PDB

BioLiP

PDB CCD ID:

TFB

Number of entries in BioLiP:

Chemical formula:

C5 H8 O3

InChI:

InChI=1S/C5H8O3/c6-5(7)4-2-1-3-8-4/h4H,1-3H2,(H,6,7)/t4-/m0/s1

InChIKey:

UJJLJRQIPMGXEZ-BYPYZUCNSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C1CC(OC1)C(=O)O
ACDLabs 10.04	O=C(O)C1OCCC1
OpenEye OEToolkits 1.5.0	C1C[C@H](OC1)C(=O)O
CACTVS 3.341	OC(=O)[C@@H]1CCCO1
CACTVS 3.341	OC(=O)[CH]1CCCO1

Name:

TETRAHYDROFURAN-2-CARBOXYLIC ACID

ZINC:

ZINC000002164321

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).