CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00035175" in compound.

Total 1 results found.

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 CFAMM00035175
Family CFFAD192 D(1A) dopamine receptor ligand ergot alkaloid Methylergonovine Family
Superfamily CFSAD178 dopamine receptor ligand ergot alkaloid Methylergonovine Cabergoline Superfamily
Class CFCAD173 Class 173
External ID CHEMBL435080 External Source CHEMBL
PubChem CID 10827961 Functional Category Bioactive
Molecule Name N-[(5-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]indol-10-yl)methyl]butanamide
IUPAC Name N-[(5-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]indol-10-yl)methyl]butanamide
Synonyms CHEBI:336590
InChi InChI=1S/C19H26N2O/c1-3-8-18(22)20-13-14-9-4-6-12-17-19(14)15-10-5-7-11-16(15)21(17)2/h5,7,10-11,14H,3-4,6,8-9,12-13H2,1-2H3,(H,20,22)
InChiKey XZFYJYVSNMNYKC-UHFFFAOYSA-N
Formula C19H26N2O Molecular Weight 298.42
Cross Link CHEMBL435080
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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