CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00254025" in compound.

Total 1 results found.

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 CFAMM00254025
Family CFFID1903 4-aminobutyrate aminotransferase, mitochondrial Inhibitor 4-hydroxybenzylamine Family
Superfamily CFSAD16 D(2) dopamine receptor ligand catecholamine Dopamine Superfamily
Class CFCAD16 Class 16
External ID HMDB32580 External Source HMDB
PubChem CID 160611 Functional Category Human Metabolite
Molecule Name 4-Hydroxybenzyl isothiocyanate
IUPAC Name 4-(isothiocyanatomethyl)phenol
Synonyms 4-(Isothiocyanatomethyl)-Phenol;4-(Isothiocyanatomethyl)phenol, 9CI;Para-hydroxybenzyl isothiocyanate
InChi InChI=1S/C8H7NOS/c10-8-3-1-7(2-4-8)5-9-6-11/h1-4,10H,5H2
InChiKey ATKWJXUJUNLTFU-UHFFFAOYSA-N
Formula C8H7NOS Molecular Weight 165.21
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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