CFam Chemical Families Database
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You are searching for "CFAMM00301728" 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 CFAMM00301728
Family CFFID4041 Acetylcholinesterase Inhibitor Lysicamine Family
Superfamily CFSID2740 Acetylcholinesterase Inhibitor Lysicamine Superfamily
Class CFCID1626 Class 2976
External ID HMDB33367 External Source HMDB
PubChem CID 3084224 Functional Category Human Metabolite
Molecule Name Oxonantenine
IUPAC Name 18,19-dimethoxy-5,7-dioxa-13-azapentacyclo[10.7.1.0²,¹⁰.0⁴,⁸.0¹⁶,²⁰]icosa-1(19),2,4(8),9,12(20),13,15,17-octaen-11-one
Synonyms 1,2-Dimethoxy-9,10-methylenedioxyoxoaporphine;Oxonantenine
InChi InChI=1S/C19H13NO5/c1-22-14-5-9-3-4-20-17-15(9)16(19(14)23-2)10-6-12-13(25-8-24-12)7-11(10)18(17)21/h3-7H,8H2,1-2H3
InChiKey NFDVJYPMLVMXRR-UHFFFAOYSA-N
Formula C19H13NO5 Molecular Weight 335.31
Cross Link CHEMBL1270949
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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