acompound

Showing entry for Loliolide

General Compound Information
BXGC Id	BXGC0003052
Compound Name	Loliolide
Structure
Formula	C11H16O3
InchiKey	XEVQXKKKAVVSMW-WRWORJQWSA-N
SMILES	C[C@@]12C[C@@H](O)CC(C)(C)C1=CC(=O)O2
Inchi	InChI=1S/C11H16O3/c1-10(2)5-7(12)6-11(3)8(10)4-9(13)14-11/h4,7,12H,5-6H2,1-3H3/t7-,11+/m0/s1
IUPAC	(6S,7aR)-6-hydroxy-4,4,7a-trimethyl-2,4,5,6,7,7a-hexahydro-1-benzofuran-2-one
Molecular Weight	196.24
Pubchem Id	100332
Chembl Id	CHEMBL227113

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

CHEMBL227113

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
P11511	BXGT007717	Aromatase	reviewed	Enzyme	CYP19A1	IC50	'>'	40	ug.mL-1
Q04206	BXGT012754	Transcription factor p65	reviewed	Transcription factor	RELA	IC50	'>'	10000	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00038	Tea	Camellia sinensis	Teas
BXGF00040	Pepper (C. annuum)	Capsicum annuum	Vegetables
BXGF00086	Sunflower	Helianthus annuus	Herbs and Spices
BXGF00508	Wakame	Undaria pinnatifida	Aquatic foods
BXGF01267	Dendrobium chrysanthum	Dendrobium chrysanthum	Medicinal Plant
BXGF01479	Fritillaria cirrhosa	Fritillaria cirrhosa	Medicinal Plant
BXGF02214	Morus bombycis	Morus bombycis	Medicinal Plant
BXGF02351	Libanothamnus occultus	Libanothamnus occultus	Others
BXGF02489	Ajuga decumbens	Ajuga decumbens	Medicinal Plant
BXGF02819	Catananche caerulea	Catananche caerulea	Others
BXGF03161	Dendrobium chrysotoxum	Dendrobium chrysotoxum	Medicinal Plant
BXGF03346	Dendrobium candidum	Dendrobium candidum	Others
BXGF03583	Epimedium koreanum	Epimedium koreanum	Medicinal Plant
BXGF03611	Viscum coloratum	Viscum coloratum	Medicinal Plant
BXGF03632	Dendrobium fimbriatum	Dendrobium fimbriatum	Medicinal Plant
BXGF04000	Viola philippica	Viola philippica	Others
BXGF04074	Cirsium wallichii	Cirsium wallichii	Medicinal Plant
BXGF04607	Morus alba	Morus alba	Medicinal Plant
BXGF04838	Aglaia elliptica	Aglaia elliptica	Medicinal Plant
BXGF04904	Samadera indica	Samadera indica	Medicinal Plant
BXGF05173	Dendrobium nobile	Dendrobium nobile	Medicinal Plant
BXGF05429	Strychnos ligustrina	Strychnos ligustrina	Medicinal Plant
BXGF05458	Phebalium whitei	Phebalium whitei	Others
BXGF05476	Broussonetia papyrifera	Broussonetia papyrifera	Medicinal Plant
BXGF05524	Rumex nepalensis	Rumex nepalensis	Medicinal Plant
BXGF05570	Rosa agrestis	Rosa agrestis	Others
BXGF05592	Vitis betulifolia	Vitis betulifolia	Human Edible Plant
BXGF05798	Corydalis calliantha	Corydalis calliantha	Others
BXGF05848	Veronica kellereri	Veronica kellereri	Others
BXGF05911	Viscum album	Viscum album	Medicinal Plant
BXGF05932	Salvia urolepis	Salvia urolepis	Others
BXGF06069	Dendrobium loddigesii	Dendrobium loddigesii	Medicinal Plant
BXGF06103	Viola mandshurica	Viola mandshurica	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}