Showing entry for n.a


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0036336
Compound Namen.a
Structure
FormulaC37H54O4
InchiKeyLTBABPUGMQQBAI-RBEMDKFASA-N
SMILESCCCCCc1cc2OC(C)(C)[C@H]3[C@H](c2c(c1C(=O)OC([C@@H]1CC[C@@]2(C(=C(C)CCC2)C1)C)(C)C)O)C=C(CC3)C
InchiInChI=1S/C37H54O4/c1-9-10-11-14-25-21-30-32(27-20-23(2)15-16-28(27)36(6,7)40-30)33(38)31(25)34(39)41-35(4,5)26-17-19-37(8)18-12-13-24(3)29(37)22-26/h20-21,26-28,38H,9-19,22H2,1-8H3/t26-,27-,28-,37-/m1/s1
IUPAC2-[(2R,4aR)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl]propan-2-yl (6aR,10aR)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylate
Molecular Weight562.4
Pubchem Id24862526
Chembl IdCHEMBL499948
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Binding DB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
CHEMBL CHEMBL499948
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P21554 BXGT008662 Cannabinoid receptor 1 reviewed G-protein coupled receptor CNR1 Activity - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF05853 Cannabis sativa Cannabis sativa Medicinal Plant
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease