acompound

Showing entry for hydroxyachillin

General Compound Information
BXGC Id	BXGC0021338
Compound Name	hydroxyachillin
Structure
Formula	C15H18O4
InchiKey	YMUOZXZDDBRJEP-XUNJKSNWSA-N
SMILES	O[C@H]1CC(=C2[C@@H]([C@@H]3[C@@H]1[C@H](C)C(=O)O3)C(=CC2=O)C)C
Inchi	InChI=1S/C15H18O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,8,10,12-14,17H,4H2,1-3H3/t8-,10-,12-,13+,14+/m0/s1
IUPAC	(3S,3aR,4S,9aS,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
Molecular Weight	262.12
Pubchem Id	6713966
Chembl Id	CHEMBL1623213

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

CHEMBL1623213

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
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	Inhibition	'='	2	%
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Inhibition	'='	29	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00049	Chicory	Cichorium intybus	Vegetables
BXGF00879	Anemone raddeana	Anemone raddeana	Others
BXGF00934	Aristolochia maxima	Aristolochia maxima	Medicinal Plant
BXGF01182	Betula mandshurica	Betula mandshurica	Medicinal Plant
BXGF01247	Achillea collina	Achillea collina	Others
BXGF01415	Mikania obtusata	Mikania obtusata	Others
BXGF01545	Balanophora harlandii	Balanophora harlandii	Others
BXGF01557	Jasminum officinale	Jasminum officinale	Medicinal Plant
BXGF01639	Mangifera persiciformis	Mangifera persiciformis	Medicinal Plant
BXGF01715	Bergenia purpurascens	Bergenia purpurascens	Medicinal Plant
BXGF01961	Polygala myrtifolia	Polygala myrtifolia	Others
BXGF02090	Ligularia platyglossa	Ligularia platyglossa	Medicinal Plant
BXGF02128	Rhodiola krylovii	Rhodiola krylovii	Others
BXGF02224	Rapanea myricoides	Rapanea myricoides	Others
BXGF02247	Crataegus sinaica	Crataegus sinaica	Human Edible Plant
BXGF02298	Malus asiatica	Malus asiatica	Medicinal Plant
BXGF02396	Artemisia vachanica	Artemisia vachanica	Others
BXGF02411	Lasiocephalus ovatus	Lasiocephalus ovatus	Others
BXGF02427	Montrouziera sphaeroidea	Montrouziera sphaeroidea	Others
BXGF02443	Cotoneaster orbicularis	Cotoneaster orbicularis	Others
BXGF02450	Bischofia trifoliata	Bischofia trifoliata	Others
BXGF02493	Polemonium caeruleum	Polemonium caeruleum	Medicinal Plant
BXGF02517	Pimpinella saxifraga	Pimpinella saxifraga	Medicinal Plant
BXGF02531	Caragana tibetica	Caragana tibetica	Medicinal Plant
BXGF02538	Macrotyloma axillare	Macrotyloma axillare	Others
BXGF02555	Trigonostemon reidioides	Trigonostemon reidioides	Medicinal Plant
BXGF02581	Euphorbia ferganensis	Euphorbia ferganensis	Others
BXGF02594	Arachniodes dimorphophylla	Arachniodes dimorphophylla	Others
BXGF02608	Oreosolen wattii	Oreosolen wattii	Others
BXGF02742	Discaria crenata	Discaria crenata	Others
BXGF03307	Strychnos ledermannii	Strychnos ledermannii	Others
BXGF03472	Tropaeolum speciosum	Tropaeolum speciosum	Others
BXGF03838	Euphorbia biglandulosa	Euphorbia biglandulosa	Others
BXGF03933	Achillea millefolium	Achillea millefolium	Medicinal Plant
BXGF04120	Solanum bahamense	Solanum bahamense	Others
BXGF04247	Tinospora smilacina	Tinospora smilacina	Medicinal Plant
BXGF04310	Taraxacum mongolicum	Taraxacum mongolicum	Medicinal Plant
BXGF04408	Sarcomelicope argyrophylla	Sarcomelicope argyrophylla	Others
BXGF04698	Isodon rubescens	Isodon rubescens	Others
BXGF04902	Lupinus cosentinii	Lupinus cosentinii	Others
BXGF05359	Viburnum davidii	Viburnum davidii	Others
BXGF05400	Agathosma scaberula	Agathosma scaberula	Others
BXGF05751	Vatica diospyroides	Vatica diospyroides	Others
BXGF06041	Pithecellobium clypearia	Pithecellobium clypearia	Medicinal Plant
BXGF06221	Annona rensoniana	Annona rensoniana	Others
BXGF06238	Gardenia jasminoides	Gardenia jasminoides	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}