CFam Chemical Families Database
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You are searching for "CFAMM00562355" in compound.

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CFAM Mol ID CFAMM00562355
Family CFFNP1770 methyl-1H-pyrrole NP (z)-2-((3,4-dimethyl-1h-pyrrol-2-yl)methylene)-5-((5-((z)-(3,4-dimethyl-2h-pyrrol-1-ium-2-ylidene)methyl)-3-ethyl-4-methyl-1h-pyrrol-2-yl)methyl)-4-ethyl-3-methyl-2h-pyrrol-1-ium Bromide Family
Superfamily CFSBM6426 Acetylcholinesterase inhibitor AC1NQMF6 Superfamily
Class CFCBM2023 Class 5073
External ID ZINC20111424 External Source ZINC
PubChem CID 28636379 Functional Category Natural Product
Molecule Name (Z)-2-((3,4-dimethyl-1H-pyrrol-2-yl)methylene)-5-((5-((Z)-(3,4-dimethyl-2H-pyrrol-1-ium-2-ylidene)methyl)-3,4-dimethyl-1H-pyrrol-2-yl)methyl)-3,4-dimethyl-2H-pyrrol-1-ium bromide
IUPAC Name 2-[(3,4-dimethylpyrrol-1-ium-2-ylidene)methyl]-5-[[5-[(Z)-(3,4-dimethylpyrrol-1-ium-2-ylidene)methyl]-3,4-dimethyl-1H-pyrrol-2-yl]methyl]-3,4-dimethyl-1H-pyrrole
Synonyms MCULE-2639830742
InChi InChI=1S/C27H32N4/c1-14-12-28-22(16(14)3)9-24-18(5)20(7)26(30-24)11-27-21(8)19(6)25(31-27)10-23-17(4)15(2)13-29-23/h9-10,12-13,30-31H,11H2,1-8H3/p+2/b22-9-,23-10?
InChiKey DMZJDVLOXHAQHD-COTYCFKYSA-P
Formula C27H34N4+2 Molecular Weight 414.59
Cross Link
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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