BioLiP

PDB

BioLiP

PDB CCD ID:

LP6

Number of entries in BioLiP:

Chemical formula:

C11 H22 N2 O2

InChI:

InChI=1S/C11H22N2O2/c12-10(11(14)15)6-2-5-9-13-7-3-1-4-8-13/h10H,1-9,12H2,(H,14,15)/t10-/m0/s1

InChIKey:

UCDGEGRDGSSPQT-JTQLQIEISA-N

SMILES:

Software	SMILES
CACTVS 3.352	N[C@@H](CCCCN1CCCCC1)C(O)=O
OpenEye OEToolkits 1.6.1	C1CCN(CC1)CCCCC(C(=O)O)N
OpenEye OEToolkits 1.6.1	C1CCN(CC1)CCCC[C@@H](C(=O)O)N
CACTVS 3.352	N[CH](CCCCN1CCCCC1)C(O)=O
ACDLabs 10.04	O=C(O)C(N)CCCCN1CCCCC1

Name:

6-piperidin-1-yl-L-norleucine

ZINC:

ZINC000058650291

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).