BioLiP

PDB

BioLiP

PDB CCD ID:

UZA

Number of entries in BioLiP:

Chemical formula:

C10 H19 N O2

InChI:

InChI=1S/C10H19NO2/c1-3-4-5-6-7-8-10(2,11)9(12)13/h4-5H,3,6-8,11H2,1-2H3,(H,12,13)/b5-4+/t10-/m0/s1

InChIKey:

FTUDBYYFEJZDPE-YEZKRMTDSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	CC/C=C/CCC[C@@](C)(C(=O)O)N
CACTVS 3.385	CCC=CCCC[C](C)(N)C(O)=O
ACDLabs 12.01	NC(C(=O)O)(C)CCC\C=C\CC
OpenEye OEToolkits 2.0.7	CCC=CCCCC(C)(C(=O)O)N
CACTVS 3.385	CC\C=C\CCC[C@](C)(N)C(O)=O

Name:

(2S,6E)-2-amino-2-methylnon-6-enoic acid

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).