CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00268335" 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 CFAMM00268335
Family CFFID2449 Melanocortin receptor 3 and Melanocortin receptor 4 Ligand C[co-o-c6h4-co-pro-d-nal(2)-arg-trp-lys]-nh2 Family
Superfamily CFSID45 Melanocortin receptor 3 and Melanocortin receptor 4 Binder Superfamily
Class CFCAD147 Class 147
External ID CHEMBL363061 External Source CHEMBL
PubChem CID 44394785 Functional Category Bioactive
Molecule Name (2S)-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-2-[[(2S)-3-(4-chlorophenyl)-2-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanamide
IUPAC Name (2S)-N-[(2S)-1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-2-[[(2S)-3-(4-chlorophenyl)-2-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanamide
Synonyms CHEBI:409500
InChi InChI=1S/C45H49ClFN9O6/c46-31-16-12-28(13-17-31)24-37(53-40(58)21-20-39(57)29-14-18-32(47)19-15-29)43(61)56-38(23-27-7-2-1-3-8-27)44(62)54-35(11-6-22-51-45(49)50)42(60)55-36(41(48)59)25-30-26-52-34-10-5-4-9-33(30)34/h1-5,7-10,12-19,26,35-38,52H,6,11,20-25H2,(H2,48,59)(H,53,58)(H,54,62)(H,55,60)(H,56,61)(H4,49,50,51)/t35-,36-,37-,38-/m0/s1
Formula C45H49ClFN9O6 Molecular Weight 866.38
Cross Link CHEMBL363061

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).

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National University of Singapore, Singapore

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