BDBM50005920 Ajulemic Acid

SMILES [H][C@@]12CC(=CC[C@@]1([H])C(C)(C)Oc1cc(cc(O)c21)C(C)(C)CCCCCC)C(O)=O

InChI Key InChIKey=YCHYFHOSGQABSW-RTBURBONSA-N

Data  3 KI  1 EC50

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50005920   

TargetCannabinoid receptor 1(Homo sapiens (Human))
The University of Massachusetts Medical School

Curated by ChEMBL
LigandPNGBDBM50005920(Ajulemic Acid)
Show SMILES CCCCCCC(C)(C)c1cc(O)c2[C@@H]3CC(=CC[C@H]3C(C)(C)Oc2c1)C(O)=O
Show InChI InChI=1S/C25H36O4/c1-6-7-8-9-12-24(2,3)17-14-20(26)22-18-13-16(23(27)28)10-11-19(18)25(4,5)29-21(22)15-17/h10,14-15,18-19,26H,6-9,11-13H2,1-5H3,(H,27,28)/t18-,19-/m1/s1
Affinity DataEC50:  927nMAssay Description:Agonist activity at CB1 receptor (unknown origin) assessed as cAMP productionMore data for this Ligand-Target Pair