BioLiP

PDB

BioLiP

PDB CCD ID:

LYN

Number of entries in BioLiP:

Chemical formula:

C6 H16 N3 O

InChI:

InChI=1S/C6H15N3O/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H2,9,10)/p+1/t5-/m0/s1

InChIKey:

HKXLAGBDJVHRQG-YFKPBYRVSA-O

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(CC[NH3+])C[C@@H](C(=O)N)N
ACDLabs 10.04	O=C(N)C(N)CCCC[NH3+]
OpenEye OEToolkits 1.5.0	C(CC[NH3+])CC(C(=O)N)N
CACTVS 3.341	N[C@@H](CCCC[NH3+])C(N)=O
CACTVS 3.341	N[CH](CCCC[NH3+])C(N)=O

Name:

2,6-DIAMINO-HEXANOIC ACID AMIDE

DrugBank:

DB03988

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).