CFam Chemical Families Database
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You are searching for "CFAMM00491916" in compound.

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CFAM Mol ID CFAMM00491916
Family CFFBM30451 Arachidonate 5-lipoxygenase inhibitor (4E)-4-[(E,4Z)-4-(3H-1,3-benzoxazol-2-ylidene)but-2-enylidene]-2-methoxycyclohexa-2,5-dien-1-one family
Superfamily CFSBM4684 Estrogen receptor and Estrogen receptor beta Binder Superfamily 17
Class CFCCD181 Class 994
External ID ZINC05047489 External Source ZINC
PubChem CID 5912923 Functional Category Natural Product
Molecule Name (E)-2-(1,3-benzoxazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
IUPAC Name (E)-2-(1,3-benzoxazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
Synonyms AC1NZO2N;STOCK4S-12311;MolPort-000-218-695;STK845273;AKOS002183296;ST50071013;AB01306345-01;(E)-2-(benzo[d]oxazol-2-yl)-3-(3,4,5-trimethoxyphe;F3139-0845;(2E)-2-benzoxazol-2-yl-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
InChi InChI=1S/C19H16N2O4/c1-22-16-9-12(10-17(23-2)18(16)24-3)8-13(11-20)19-21-14-6-4-5-7-15(14)25-19/h4-10H,1-3H3/b13-8+
InChiKey UWNPNIJRYVUOOW-MDWZMJQESA-N
Formula C19H16N2O4 Molecular Weight 336.34
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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