acompound

Showing entry for Sesquicannabigerol

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0053902
Compound Name	Sesquicannabigerol
Structure
Formula	C26H40O2
InchiKey	WYEFRBILENQYOH-CZHHEZJISA-N
SMILES	CCCCCc1cc(O)c(c(c1)O)C/C=C(/CC/C=C(/CCC=C(C)C)\C)\C
Inchi	InChI=1S/C26H40O2/c1-6-7-8-15-23-18-25(27)24(26(28)19-23)17-16-22(5)14-10-13-21(4)12-9-11-20(2)3/h11,13,16,18-19,27-28H,6-10,12,14-15,17H2,1-5H3/b21-13+,22-16+
IUPAC	5-pentyl-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzene-1,3-diol
Molecular Weight	384.3
Pubchem Id	54669855
Chembl Id	CHEMBL1823117

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

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
reviewed	BXGT009779	Cannabinoid receptor 2	reviewed	G-protein coupled receptor	CNR2	180	-	-	-
reviewed	BXGT018556	Transient receptor potential cation channel subfamily V member 1	reviewed	Ion channel	TRPV1	-	5700	-	-
reviewed	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed		Trpa1	-	-	-	1700
reviewed	BXGT021939	Transient receptor potential cation channel subfamily V member 2	reviewed		Trpv2	-	-	-	2700
reviewed	BXGT008662	Cannabinoid receptor 1	reviewed	G-protein coupled receptor	CNR1	750	-	-	-
reviewed	BXGT018556	Transient receptor potential cation channel subfamily V member 1	reviewed	Ion channel	TRPV1	-	-	-	4400
reviewed	BXGT008662	Cannabinoid receptor 1	reviewed	G-protein coupled receptor	CNR1	-	3270	-	-
reviewed	BXGT009779	Cannabinoid receptor 2	reviewed	G-protein coupled receptor	CNR2	-	710	-	-
reviewed	BXGT021939	Transient receptor potential cation channel subfamily V member 2	reviewed		Trpv2	-	2300	-	-
reviewed	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed		Trpa1	-	1200	-	-
reviewed	BXGT018684	Transient receptor potential cation channel subfamily M member 8	reviewed		Trpm8	-	950	-	-

CHEMBL

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
Q8NER1	BXGT018556	Transient receptor potential cation channel subfamily V member 1	reviewed	Ion channel	TRPV1	EC50	'='	4400	nM
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	EC50	'='	1700	nM
Q8R455	BXGT018684	Transient receptor potential cation channel subfamily M member 8	reviewed	-	Trpm8	IC50	'='	950	nM
Q8NER1	BXGT018556	Transient receptor potential cation channel subfamily V member 1	reviewed	Ion channel	TRPV1	IC50	'='	5700	nM
P34972	BXGT009779	Cannabinoid receptor 2	reviewed	G-protein coupled receptor	CNR2	Ki	'='	180	nM
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	IC50	'='	1200	nM
Q8NER1	BXGT018556	Transient receptor potential cation channel subfamily V member 1	reviewed	Ion channel	TRPV1	Emax	'='	38	%
Q6RI86	BXGT016509	Transient receptor potential cation channel subfamily A member 1	reviewed	-	Trpa1	Emax	'='	164	%
Q9WUD2	BXGT021939	Transient receptor potential cation channel subfamily V member 2	reviewed	-	Trpv2	Emax	'='	56	%
Q9WUD2	BXGT021939	Transient receptor potential cation channel subfamily V member 2	reviewed	-	Trpv2	EC50	'='	2700	nM
P21554	BXGT008662	Cannabinoid receptor 1	reviewed	G-protein coupled receptor	CNR1	IC50	'='	3270	nM
P21554	BXGT008662	Cannabinoid receptor 1	reviewed	G-protein coupled receptor	CNR1	Ki	'='	750	nM
Q9WUD2	BXGT021939	Transient receptor potential cation channel subfamily V member 2	reviewed	-	Trpv2	IC50	'='	2300	nM
P34972	BXGT009779	Cannabinoid receptor 2	reviewed	G-protein coupled receptor	CNR2	IC50	'='	710	nM

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}