BDBM50332940 (S)-jalapinolic acid 11-O-(2-O-trans-cinnamoyl)-[(4-O-n-dodecanoyl)]-alpha-L-rhamnopyranosyl-(1->4)-O-(2-O-n-dodecanoyl)-alpha-L-rhamnopyranosyl-(1->4)-O-alpha-L-rhamnopyranosyl-(1->2)-O-beta-D-fucopyranoside 1,2'' ester::CHEMBL1631410

SMILES CCCCCCCCCCCC(=O)O[C@H]1[C@H](C)O[C@@H](O[C@H]2[C@H](C)O[C@@H](O[C@H]3[C@H](C)O[C@H]4O[C@@H]5[C@@H](O)[C@@H](O)[C@@H](C)O[C@H]5O[C@@H](CCCCC)CCCCCCCCCC(=O)O[C@@H]4[C@@H]3O)[C@H](OC(=O)CCCCCCCCCCC)[C@@H]2O)[C@H](OC(=O)\C=C\c2ccccc2)[C@@H]1O

InChI Key InChIKey=FSDJTONUQZBFFY-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50332940   

TargetProstaglandin G/H synthase 1(Sheep)
Tokushima Bunri University

Curated by ChEMBL
LigandPNGBDBM50332940((S)-jalapinolic acid 11-O-(2-O-trans-cinnamoyl)-[(...)
Affinity DataIC50: 1.32E+5nMAssay Description:Inhibition of sheep COX1-mediated PGE2 production after 2 mins by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2011
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Sheep)
Tokushima Bunri University

Curated by ChEMBL
LigandPNGBDBM50332940((S)-jalapinolic acid 11-O-(2-O-trans-cinnamoyl)-[(...)
Affinity DataIC50: 1.47E+5nMAssay Description:Inhibition of sheep COX2-mediated PGE2 production after 2 mins by liquid scintillation countingMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2011
Entry Details Article
PubMed