BDBM50322765 3-O-beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranosyl-(1-)-beta-D-ribopyranosyl-(1-3)-alpha-L-rhamnopyranosyl-(1-2)-alpha-L-arabinopyranosylhederagenin 28-O-alpha-L-rhamnopyranosyl-(1-4)-beta-D-glucopyranosyl-(1-6)-beta-Dglucopyranoside::CHEMBL1171455

SMILES C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](OC[C@H]3O[C@@H](OC(=O)[C@]45CCC(C)(C)C[C@H]4C4=CC[C@@H]6[C@@]7(C)CC[C@H](O[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O[C@@H]8O[C@@H](C)[C@H](O)[C@@H](O[C@@H]9OC[C@@H](O[C@@H]%10O[C@H](CO)[C@@H](O[C@@H]%11O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%11O)[C@H](O)[C@H]%10O)[C@@H](O)[C@H]9O)[C@H]8O)[C@@](C)(CO)[C@@H]7CC[C@@]6(C)[C@]4(C)CC5)[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@H](O)[C@H](O)[C@H]1O

InChI Key InChIKey=RSXCUISJJNMWSU-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 = 50322765   

TargetProstaglandin G/H synthase 1(Human)
Peking University Health Science Center

Curated by ChEMBL
LigandPNGBDBM50322765(3-O-beta-D-glucopyranosyl-(1-4)-beta-D-glucopyrano...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of COX1 by microplate readerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2010
Entry Details Article
PubMed
TargetProstaglandin G/H synthase 2(Human)
Peking University Health Science Center

Curated by ChEMBL
LigandPNGBDBM50322765(3-O-beta-D-glucopyranosyl-(1-4)-beta-D-glucopyrano...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of COX2 by microplate readerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2010
Entry Details Article
PubMed