acompound

Showing entry for Helioscopinolide E

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0042830
Compound Name	Helioscopinolide E
Structure
Formula	C20H26O3
InchiKey	JFINBCWMRIJTDN-NLDJYOPPSA-N
SMILES	CC1=C2C=C3CC[C@H]4[C@@]([C@@H]3C[C@H]2OC1=O)(C)CCC(=O)C4(C)C
Inchi	InChI=1S/C20H26O3/c1-11-13-9-12-5-6-16-19(2,3)17(21)7-8-20(16,4)14(12)10-15(13)23-18(11)22/h9,14-16H,5-8,10H2,1-4H3/t14-,15-,16-,20+/m1/s1
IUPAC	(4aS,10aR,11aR,11bS)-4,4,8,11b-tetramethyl-1,2,4a,5,6,10a,11,11a-octahydronaphtho[2,1-f][1]benzofuran-3,9-dione
Molecular Weight	314.19
Pubchem Id	11565893
Chembl Id	CHEMBL1078406

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

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
P18031	BXGT008369	Tyrosine-protein phosphatase non-receptor type 1	reviewed	-	PTPN1	Inhibition	-	-	-
P08183	BXGT006741	ATP-dependent translocase ABCB1	reviewed	Transporter	ABCB1	Ratio	'='	10	-
P08183	BXGT006741	ATP-dependent translocase ABCB1	reviewed	Transporter	ABCB1	CI	'='	0	-
P08183	BXGT006741	ATP-dependent translocase ABCB1	reviewed	Transporter	ABCB1	Ratio	'='	1	-
P08183	BXGT006741	ATP-dependent translocase ABCB1	reviewed	Transporter	ABCB1	Ratio	'='	0	-
P08183	BXGT006741	ATP-dependent translocase ABCB1	reviewed	Transporter	ABCB1	Ratio	'='	0	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF02541	Euphorbia pekinensis	Euphorbia pekinensis	Medicinal Plant
BXGF04112	Euphorbia micractina	Euphorbia micractina	Others
BXGF04170	Dryopteris sacrosancta	Dryopteris sacrosancta	Medicinal Plant
BXGF04184	Eleusine indica	Eleusine indica	Medicinal Plant
BXGF04226	Lemna trisulca	Lemna trisulca	Others
BXGF04265	Rubus koehneanus	Rubus koehneanus	Others
BXGF04277	Caesalpinia pulcherrima	Caesalpinia pulcherrima	Medicinal Plant
BXGF04286	Heimia salicifolia	Heimia salicifolia	Medicinal Plant
BXGF04317	Microlepia speluncae	Microlepia speluncae	Medicinal Plant
BXGF04331	Narcissus asturiensis	Narcissus asturiensis	Others
BXGF04336	Astragalus interpositus	Astragalus interpositus	Others
BXGF04792	Scutellaria orientalis	Scutellaria orientalis	Medicinal Plant
BXGF05250	Tripteris vaillantii	Tripteris vaillantii	Medicinal Plant
BXGF06086	Euphorbia wallichii	Euphorbia wallichii	Others

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}