BioLiP

PDB

BioLiP

PDB CCD ID:

CWF

Number of entries in BioLiP:

Chemical formula:

C9 H19 N O2

InChI:

InChI=1S/C9H19NO2/c1-8(10)6-4-2-3-5-7-9(11)12/h8H,2-7,10H2,1H3,(H,11,12)/t8-/m0/s1

InChIKey:

VXBHEKXWXPQBQM-QMMMGPOBSA-N

SMILES:

Software	SMILES
CACTVS 3.385	C[C@H](N)CCCCCCC(O)=O
OpenEye OEToolkits 2.0.7	C[C@@H](CCCCCCC(=O)O)N
CACTVS 3.385	C[CH](N)CCCCCCC(O)=O
OpenEye OEToolkits 2.0.7	CC(CCCCCCC(=O)O)N

Name:

(8S)-8-azanylnonanoic 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).