CFam Chemical Families Database
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You are searching for "CFAMM00421754" in compound.

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CFAM Mol ID CFAMM00421754
Family CFFBM13313 Neuronal acetylcholine receptor subunit alpha-6 ligand AGN-PC-04X4WY family
Superfamily CFSID2185 Acetylcholinesterase and Cholinesterase Inhibitor 1,9-bis(pyridinium)-nonane Dibromide Superfamily
Class CFCID318 Class 1668
External ID CHEMBL239844 External Source CHEMBL
PubChem CID 25142323 Functional Category Bioactive
Molecule Name AGN-PC-04X4WY
IUPAC Name 1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methylpyridin-1-ium;tribromide
Synonyms CHEBI:502472;1-[5-[3,5-bis[5-(3-methylpyridin-1-ium-1-yl)pent-1-ynyl]phenyl]pent-4-ynyl]-3-methylpyridin-1-ium;tribromide
InChi InChI=1S/C39H42N3.3BrH/c1-34-16-13-25-40(31-34)22-10-4-7-19-37-28-38(20-8-5-11-23-41-26-14-17-35(2)32-41)30-39(29-37)21-9-6-12-24-42-27-15-18-36(3)33-42;;;/h13-18,25-33H,4-6,10-12,22-24H2,1-3H3;3*1H/q+3;;;/p-3
Formula C39H42Br3N3 Molecular Weight 792.48
Cross Link CHEMBL239844

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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