CFam Chemical Families Database
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You are searching for "CFAMM00304131" in compound.

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CFAM Mol ID CFAMM00304131
Family CFFID4213 Melanocortin receptor 4 and Melanocyte-stimulating hormone receptor Ligand D-phe-arg-2-nal-nhch3 Family
Superfamily CFSID125 Melanocortin receptor 4 and Major prion protein Binder Superfamily
Class CFCID4 Class 1354
External ID CHEMBL80447 External Source CHEMBL
PubChem CID 44317336 Functional Category Bioactive
Molecule Name methyl (2S)-2-[[(2S)-4-amino-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2R)-2-(ethoxycarbonylamino)-3-naphthalen-1-ylpropanoyl]-methylamino]pentanoyl]amino]-4-oxobutanoyl]amino]-3-methylbutanoate
IUPAC Name methyl (2S)-2-[[(2S)-4-amino-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2R)-2-(ethoxycarbonylamino)-3-naphthalen-1-ylpropanoyl]-methylamino]pentanoyl]amino]-4-oxobutanoyl]amino]-3-methylbutanoate
Synonyms CHEBI:226950
InChi InChI=1S/C33H48N8O8/c1-6-49-33(47)39-24(17-21-13-9-12-20-11-7-8-14-22(20)21)30(45)41(4)25(15-10-16-37-32(35)36)29(44)38-23(18-26(34)42)28(43)40-27(19(2)3)31(46)48-5/h7-9,11-14,19,23-25,27H,6,10,15-18H2,1-5H3,(H2,34,42)(H,38,44)(H,39,47)(H,40,43)(H4,35,36,37)/t23-,24+,25-,27-/m0/s1
InChiKey WEAHFODXINKIKT-SFIUMABJSA-N
Formula C33H48N8O8 Molecular Weight 684.78
Cross Link CHEMBL80447
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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