CFam Chemical Families Database
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You are searching for "CFAMM00223650" 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 CFAMM00223650
Family CFFID964 Adenosine receptor A1 and Adenosine receptor A2a Ligand N6-methoxy-2-[(3-pyridinyl)ethynyl]-adenosine Family
Superfamily CFSID222 Adenosine receptor A2a and Adenosine receptor A1 Binder Superfamily
Class CFCAD652 Class 652
External ID CHEMBL422122 External Source CHEMBL
PubChem CID 11015254 Functional Category Bioactive
Molecule Name (2S,3S,4R,5R)-2-(aminomethyl)-5-(4-anilino-5-phenylpyrrolo[2,3-d]pyrimidin-7-yl)oxolane-3,4-diol
IUPAC Name (2S,3S,4R,5R)-2-(aminomethyl)-5-(4-anilino-5-phenylpyrrolo[2,3-d]pyrimidin-7-yl)oxolane-3,4-diol
Synonyms CHEBI:338639
InChi InChI=1S/C23H23N5O3/c24-11-17-19(29)20(30)23(31-17)28-12-16(14-7-3-1-4-8-14)18-21(25-13-26-22(18)28)27-15-9-5-2-6-10-15/h1-10,12-13,17,19-20,23,29-30H,11,24H2,(H,25,26,27)/t17-,19+,20+,23+/m0/s1
InChiKey BWNFRRROBVAMGH-JEBQKTDQSA-N
Formula C23H23N5O3 Molecular Weight 417.46
Cross Link CHEMBL422122
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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