CFam Chemical Families Database
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You are searching for "CFAMM00302220" in compound.

Total 1 results found.

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CFAM Mol ID CFAMM00302220
Family CFFID4093 cAMP-dependent protein kinase type I-alpha regulatory subunit and cAMP-dependent protein kinase type II-beta regulatory subunit Inhibitor Adcahxarg4nh(ch2)6nh2 Family
Superfamily CFSCD172 Adenosine receptor A2a Binder Superfamily
Class CFCAD172 Class 172
External ID CHEMBL495088 External Source CHEMBL
PubChem CID 25190784 Functional Category Bioactive
Molecule Name (2S,3S,4R,5R)-N-[6-[[(2R)-6-amino-1-[[8-[[(2R)-1-[[(2R)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-8-oxooctyl]amino]-1-oxohexan-2-yl]amino]-6-oxohexyl]-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxamide
IUPAC Name (2S,3S,4R,5R)-N-[6-[[(2R)-6-amino-1-[[8-[[(2R)-1-[[(2R)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-8-oxooctyl]amino]-1-oxohexan-2-yl]amino]-6-oxohexyl]-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carboxamide
Synonyms ARC-1019;ARC-1019, 17
InChi InChI=1S/C42H74N18O9/c43-18-8-7-13-26(57-28(61)17-6-4-10-20-51-39(68)33-31(63)32(64)40(69-33)60-24-56-30-34(44)54-23-55-36(30)60)37(66)50-19-9-3-1-2-5-16-29(62)58-27(15-12-22-53-42(48)49)38(67)59-25(35(45)65)14-11-21-52-41(46)47/h23-27,31-33,40,63-64H,1-22,43H2,(H2,45,65)(H,50,66)(H,51,68)(H,57,61)(H,58,62)(H,59,67)(H2,44,54,55)(H4,46,47,52)(H4,48,49,53)/t25-,26-,27-,31+,32-,33+,40-/m1/s1
InChiKey USTJOCLNMJUQHM-RGVWGEFISA-N
Formula C42H74N18O9 Molecular Weight 975.15
Cross Link CHEMBL495088
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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National University of Singapore, Singapore


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