CFam Chemical Families Database
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You are searching for "CFAMM00037874" 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 CFAMM00037874
Family CFFAD216 Gastrin/cholecystokinin type B receptor ligand peptide Pentagastrin Family
Superfamily CFSAD196 peptide hormone receptor ligand peptide Pentagastrin Octreotide Superfamily
Class CFCAD189 Class 189
External ID CHEMBL436569 External Source CHEMBL
PubChem CID 10457660 Functional Category Bioactive
Molecule Name methyl (3S,4S)-3-acetylsulfanyl-4-[[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]carbamoyl]-6-methylheptanoate
IUPAC Name methyl (3S,4S)-3-acetylsulfanyl-4-[[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]carbamoyl]-6-methylheptanoate
Synonyms CHEBI:314975
InChi InChI=1S/C24H33N3O5S/c1-14(2)10-18(21(33-15(3)28)12-22(29)32-5)23(30)27-20(24(31)25-4)11-16-13-26-19-9-7-6-8-17(16)19/h6-9,13-14,18,20-21,26H,10-12H2,1-5H3,(H,25,31)(H,27,30)/t18-,20+,21+/m1/s1
InChiKey JZEPIVKJGNYWHP-GIVPXCGWSA-N
Formula C24H33N3O5S Molecular Weight 475.60
Cross Link CHEMBL436569
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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