CFam Chemical Families Database
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You are searching for "CFAMM00481046" in compound.

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CFAM Mol ID CFAMM00481046
Family CFFBM27014 Mu-type opioid receptor ligand 2-[[2-[(2R)-2-ethyl-4-(4-fluorophenyl)-2-methyloxan-4-yl]ethylamino]methyl]phenol family
Superfamily CFSBM5481 Cathepsin D and Beta-secretase 1 Binder Superfamily 9
Class CFCBM1545 Class 4595
External ID ZINC00210034 External Source ZINC
PubChem CID 6937644 Functional Category Natural Product
Molecule Name AC1OCF6C
IUPAC Name [(4S)-2,2-dimethyloxan-4-yl]-[(4-hydroxyphenyl)methyl]azanium
Synonyms ZINC00210034;[(4S)-2,2-dimethyloxan-4-yl]-[(4-hydroxyphenyl)methyl]azanium
InChi InChI=1S/C14H21NO2/c1-14(2)9-12(7-8-17-14)15-10-11-3-5-13(16)6-4-11/h3-6,12,15-16H,7-10H2,1-2H3/p+1/t12-/m0/s1
InChiKey PVWMKLSLRANGDD-LBPRGKRZSA-O
Formula C14H22NO2+ Molecular Weight 236.33
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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