BioLiP

PDB

BioLiP

PDB CCD ID:

308

Number of entries in BioLiP:

Chemical formula:

C10 H17 N

InChI:

InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2/t7-,8+,9-,10-

InChIKey:

DKNWSYNQZKUICI-CHIWXEEVSA-N

SMILES:

Software	SMILES
CACTVS 3.341	NC12CC3CC(CC(C3)C1)C2
ACDLabs 10.04	NC12CC3CC(C1)CC(C2)C3
OpenEye OEToolkits 1.5.0	C1C2CC3CC1CC(C2)(C3)N

Name:

(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]decan-1-amine;
Amantadine

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).