CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00011697" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00011697
Family CFFAD60 5-hydroxytryptamine receptor 1B and 5-hydroxytryptamine receptor 1D ligand triptan analog Frovatriptan family
Superfamily CFSAD59 5-hydroxytryptamine receptor 1B and 5-hydroxytryptamine receptor 1D ligand triptan analog Frovatriptan Superfamily
Class CFCAD59 Class 59
External ID ZINC04011872 External Source ZINC
PubChem CID 2827442 Functional Category Natural Product
Molecule Name 2-butyl-6-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-one
IUPAC Name 2-butyl-6-methyl-4,9-dihydro-3H-pyrido[3,4-b]indol-1-one
Synonyms MLS000052984;AC1MCXE4;regid4262984;Oprea1_251020;Oprea1_673078;STOCK1N-13271;MolPort-002-110-878;HMS2376G16;STK326775;ZINC04011872
InChi InChI=1S/C16H20N2O/c1-3-4-8-18-9-7-12-13-10-11(2)5-6-14(13)17-15(12)16(18)19/h5-6,10,17H,3-4,7-9H2,1-2H3
InChiKey FZDYMDQAQKXEES-UHFFFAOYSA-N
Formula C16H20N2O Molecular Weight 256.34
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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