CFam Chemical Families Database
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You are searching for "CFAMM00296471" 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 CFAMM00296471
Family CFFID3707 Delta-type opioid receptor and Kappa-type opioid receptor Ligand Dcp-c[d-cys-gly-phe(pno2)-d-cys]nh2 Family
Superfamily CFSID2541 Delta-type opioid receptor and Kappa-type opioid receptor Ligand Dcp-c[d-cys-gly-phe(pno2)-d-cys]nh2 Superfamily
Class CFCID275 Class 1625
External ID CHEMBL113782 External Source CHEMBL
PubChem CID 44343015 Functional Category Bioactive
Molecule Name (4R,7R,13R)-13-[[(2S)-2-amino-3-phenylpropanoyl]amino]-7-[(4-nitrophenyl)methyl]-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxamide
IUPAC Name (4R,7R,13R)-13-[[(2S)-2-amino-3-phenylpropanoyl]amino]-7-[(4-nitrophenyl)methyl]-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxamide
Synonyms CHEBI:290211
InChi InChI=1S/C26H31N7O7S2/c27-18(10-15-4-2-1-3-5-15)24(36)32-21-14-42-41-13-20(23(28)35)31-26(38)19(30-22(34)12-29-25(21)37)11-16-6-8-17(9-7-16)33(39)40/h1-9,18-21H,10-14,27H2,(H2,28,35)(H,29,37)(H,30,34)(H,31,38)(H,32,36)/t18-,19+,20-,21-/m0/s1
InChiKey SKQRZVBGKOLTKG-WOZUAGRISA-N
Formula C26H31N7O7S2 Molecular Weight 617.70
Cross Link CHEMBL113782
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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