CFam Chemical Families Database
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You are searching for "CFAMM00215297" in compound.

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CFAM Mol ID CFAMM00215297
Family CFFID605 Histamine H3 receptor Ligand UCL-2138 Family
Superfamily CFSID497 Histamine H3 receptor and Sodium-dependent serotonin transporter Binder Superfamily
Class CFCAD280 Class 280
External ID ZINC01831740 External Source ZINC
PubChem CID 1608063 Functional Category Natural Product
Molecule Name AC1LUIRL
IUPAC Name 2-[(2S,4R)-2-ethyl-4-hydroxy-2-methyloxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium
Synonyms ZINC01831740;2-[(2S,4R)-2-ethyl-4-hydroxy-2-methyloxan-4-yl]ethyl-[(4-methoxyphenyl)methyl]azanium
InChi InChI=1S/C18H29NO3/c1-4-17(2)14-18(20,10-12-22-17)9-11-19-13-15-5-7-16(21-3)8-6-15/h5-8,19-20H,4,9-14H2,1-3H3/p+1/t17-,18+/m0/s1
InChiKey XIYRZHDDGQJIMA-ZWKOTPCHSA-O
Formula C18H30NO3+ Molecular Weight 308.44
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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