acompound

Showing entry for Dehydrocostuslactone

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0018370
Compound Name	Dehydrocostuslactone
Structure
Formula	C15H18O2
InchiKey	NETSQGRTUNRXEO-XUXIUFHCSA-N
SMILES	C=C1C(=O)O[C@H]2[C@H]1CCC(=C)[C@H]1[C@@H]2C(=C)CC1
Inchi	InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h11-14H,1-7H2/t11-,12-,13-,14-/m0/s1
IUPAC	(3aS,6aR,9aR,9bS)-3,6,9-trimethylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one
Molecular Weight	230.13
Pubchem Id	73174
Chembl Id	CHEMBL88985

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	BXGT007092	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	reviewed		murA	-	>50000	-	-
reviewed	BXGT020625	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	reviewed		murA	-	>50000	-	-
reviewed	BXGT005729	Transcriptional activator Myb	reviewed		MYB	-	9550	-	-
reviewed	BXGT005729	Transcriptional activator Myb	reviewed		MYB	-	9540	-	-

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
P0A749	BXGT007092	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	reviewed	-	murA	IC50	'>'	50000	nM
P01103	BXGT005729	Transcriptional activator Myb	reviewed	-	MYB	IC50	'='	9540	nM
Q9HVW7	BXGT020625	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	reviewed	-	murA	IC50	'>'	50000	nM
P01103	BXGT005729	Transcriptional activator Myb	reviewed	-	MYB	IC50	'='	9549	nM
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	Inhibition	'='	10	%
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Inhibition	'='	4	%
P0A749	BXGT007092	UDP-N-acetylglucosamine 1-carboxyvinyltransferase	reviewed	-	murA	Activity	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00097	Sweet bay	Laurus nobilis	Herbs and Spices
BXGF00205	Corn	Zea mays	Cereals and cereal products
BXGF00927	Dolomiaea souliei	Dolomiaea souliei	Others
BXGF03075	Tamarix nilotica	Tamarix nilotica	Others
BXGF04109	Saussurea costus	Saussurea costus	Medicinal Plant
BXGF05834	Schisandra sphenanthera	Schisandra sphenanthera	Medicinal Plant
BXGF05895	Commiphora myrrha	Commiphora myrrha	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}