BioLiP

PDB

BioLiP

PDB CCD ID:

6SP

Number of entries in BioLiP:

Chemical formula:

C4 H9 N O

InChI:

InChI=1S/C4H9NO/c6-4-1-2-5-3-4/h4-6H,1-3H2/t4-/m0/s1

InChIKey:

JHHZLHWJQPUNKB-BYPYZUCNSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.2	C1CNC[C@H]1O
ACDLabs 12.01	OC1CCNC1
CACTVS 3.370	O[C@H]1CCNC1
OpenEye OEToolkits 1.7.2	C1CNCC1O
CACTVS 3.370	O[CH]1CCNC1

Name:

(3S)-pyrrolidin-3-ol

ZINC:

ZINC000001574930

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).