CFam Chemical Families Database
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You are searching for "CFAMM00190388" in compound.

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CFAM Mol ID CFAMM00190388
Family CFFID396 5-hydroxytryptamine receptor 2A and 5-hydroxytryptamine receptor 2B Ligand LY53857 Family
Superfamily CFSID323 5-hydroxytryptamine receptor 2A and 5-hydroxytryptamine receptor 2B Ligand LY53857 Superfamily
Class CFCCD405 Class 1218
External ID DNC000909 External Source TTD
PubChem CID 6437377 Functional Category Investigative Drug
Molecule Name LY53857
IUPAC Name (Z)-but-2-enedioic acid;3-hydroxybutan-2-yl (6aR,9R,10aR)-7-methyl-4-propan-2-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxylate
Synonyms LY 53857;LY-53,857 maleate;LY-53857;Ergoline-8-carboxylic acid, 6-methyl-1-(1-methylethyl)-, 2-hydroxy-1-methylpropyl ester, (8beta)-, (Z)-2-butenedioate (1:1) (salt);LY53857;SureCN2970215;6-Methyl-1-(1-methylethyl)-;C23H32N2O3.C4H4O4;DNC000909;NCGC00094069-01
InChi InChI=1S/C23H32N2O3.C4H4O4/c1-13(2)25-12-16-10-21-19(18-7-6-8-20(25)22(16)18)9-17(11-24(21)5)23(27)28-15(4)14(3)26;5-3(6)1-2-4(7)8/h6-8,12-15,17,19,21,26H,9-11H2,1-5H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t14?,15?,17-,19-,21-;/m1./s1
Formula C27H36N2O7 Molecular Weight 500.58
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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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