BioLiP

PDB

BioLiP

PDB CCD ID:

A1IWV

Number of entries in BioLiP:

Chemical formula:

C5 H11 N O

InChI:

InChI=1S/C5H11NO/c7-5-2-1-3-6-4-5/h5-7H,1-4H2/t5-/m1/s1

InChIKey:

BIWOSRSKDCZIFM-RXMQYKEDSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C1CC(CNC1)O
CACTVS 3.385	O[C@@H]1CCCNC1
CACTVS 3.385	O[CH]1CCCNC1
OpenEye OEToolkits 2.0.7	C1C[C@H](CNC1)O

Name:

(3~{R})-piperidin-3-ol

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).