acompound

Showing entry for coniferin

General Compound Information
BXGC Id	BXGC0033020
Compound Name	coniferin
Structure
Formula	C16H22O8
InchiKey	SFLMUHDGSQZDOW-FAOXUISGSA-N
SMILES	OC/C=C/c1ccc(c(c1)OC)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
Inchi	InChI=1S/C16H22O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-5,7,12-21H,6,8H2,1H3/b3-2+/t12-,13-,14+,15-,16-/m1/s1
IUPAC	(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-[(E)-3-hydroxyprop-1-enyl]-2-methoxyphenoxy]oxane-3,4,5-triol
Molecular Weight	342.13
Pubchem Id	5280372
Chembl Id	CHEMBL459056

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

50269612

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	BXGT008837	Prostaglandin G/H synthase 1	reviewed	Enzyme	PTGS1	-	75000	-	-

CHEMBL

CHEMBL459056

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
P23219	BXGT008837	Prostaglandin G/H synthase 1	reviewed	Enzyme	PTGS1	IC50	'='	75000	nM
P39748	BXGT010134	Flap endonuclease 1	reviewed	Enzyme	FEN1	Potency	-	3981	nM
P18031	BXGT008369	Tyrosine-protein phosphatase non-receptor type 1	reviewed	-	PTPN1	Activity	'='	99	%
P18031	BXGT008369	Tyrosine-protein phosphatase non-receptor type 1	reviewed	-	PTPN1	IC50	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00043	Caraway	Carum carvi	Herbs and Spices
BXGF00337	Ginkgo nuts	Ginkgo biloba	Herbs and Spices
BXGF00979	Cistanche deserticola	Cistanche deserticola	Medicinal Plant
BXGF01196	Elaeagnus commutata	Elaeagnus commutata	Medicinal Plant
BXGF01263	Adenopeltis colliguaya	Adenopeltis colliguaya	Others
BXGF01372	Quercus mongolica	Quercus mongolica	Medicinal Plant
BXGF01380	Cneorum pulverulentum	Cneorum pulverulentum	Medicinal Plant
BXGF01446	Perityle vaseyi	Perityle vaseyi	Others
BXGF01566	Pedicularis condensata	Pedicularis condensata	Others
BXGF01605	Palafoxia rosea	Palafoxia rosea	Others
BXGF01643	Chrozophora obliqua	Chrozophora obliqua	Medicinal Plant
BXGF01717	Senecio flavus	Senecio flavus	Medicinal Plant
BXGF01749	Salvia coulteri	Salvia coulteri	Others
BXGF01855	Porella swartziana	Porella swartziana	Others
BXGF01856	Aquilaria sinensis	Aquilaria sinensis	Medicinal Plant
BXGF01948	Meconopsis napaulensis	Meconopsis napaulensis	Medicinal Plant
BXGF01968	Rheum webbianum	Rheum webbianum	Medicinal Plant
BXGF01999	Mascarenhasia arborescens	Mascarenhasia arborescens	Others
BXGF02028	Artemisia giraldii	Artemisia giraldii	Others
BXGF02029	Eucalyptus flocktoniae	Eucalyptus flocktoniae	Others
BXGF02057	Kummerowia striata	Kummerowia striata	Medicinal Plant
BXGF02076	Calystegia pubescens	Calystegia pubescens	Medicinal Plant
BXGF02112	Thymbra spicata	Thymbra spicata	Medicinal Plant
BXGF02135	Phoebe formosana	Phoebe formosana	Others
BXGF02153	Sida cordifolia	Sida cordifolia	Medicinal Plant
BXGF02258	Millettia conraui	Millettia conraui	Medicinal Plant
BXGF02278	Centaurea seridis	Centaurea seridis	Others
BXGF02309	Flindersia brayleyana	Flindersia brayleyana	Others
BXGF02335	Satureja cuneifolia	Satureja cuneifolia	Human Edible Plant
BXGF02358	Consolida ajacis	Consolida ajacis	Medicinal Plant
BXGF02815	Pinellia ternata	Pinellia ternata	Medicinal Plant
BXGF02885	Millettia pinnata	Millettia pinnata	Medicinal Plant
BXGF03015	Gmelina arborea	Gmelina arborea	Medicinal Plant
BXGF03063	Gentiana straminea	Gentiana straminea	Medicinal Plant
BXGF03207	Kalopanax septemlobus	Kalopanax septemlobus	Medicinal Plant
BXGF03427	Phellodendron chinense	Phellodendron chinense	Medicinal Plant
BXGF03516	Gentiana macrophylla	Gentiana macrophylla	Medicinal Plant
BXGF03623	Heracleum sphondylium	Heracleum sphondylium	Medicinal Plant
BXGF03666	Bituminaria bituminosa	Bituminaria bituminosa	Medicinal Plant
BXGF03779	Picea glauca	Picea glauca	Medicinal Plant
BXGF03828	Phellodendron amurense	Phellodendron amurense	Medicinal Plant
BXGF04140	Dalbergia stipulacea	Dalbergia stipulacea	Medicinal Plant
BXGF04256	Phellodendron chinese	Phellodendron chinese	Others
BXGF04357	Gentiana dahurica	Gentiana dahurica	Medicinal Plant
BXGF04641	Albizia procera	Albizia procera	Medicinal Plant
BXGF04787	Valeriana jatamansi	Valeriana jatamansi	Medicinal Plant
BXGF04908	Diospyros glaucifolia	Diospyros glaucifolia	Others
BXGF05028	Lampranthus sociorum	Lampranthus sociorum	Others
BXGF05036	ducrosia ismaelis	ducrosia ismaelis	Others
BXGF05080	Jungermannia obovata	Jungermannia obovata	Others
BXGF05085	Perymenium mendezii	Perymenium mendezii	Others
BXGF05124	Gentiana crassicaulis	Gentiana crassicaulis	Medicinal Plant
BXGF05186	Hortonia floribunda	Hortonia floribunda	Others
BXGF05219	Nauclea rhynchophylla	Nauclea rhynchophylla	Others
BXGF05394	Turraeanthus mannii	Turraeanthus mannii	Others
BXGF05430	Coleus garckeanus	Coleus garckeanus	Others
BXGF05490	Solanum sisymbriifolium	Solanum sisymbriifolium	Medicinal Plant
BXGF05495	Bursera tonkinensis	Bursera tonkinensis	Medicinal Plant
BXGF05519	Gerbera piloselloides	Gerbera piloselloides	Medicinal Plant
BXGF05569	Achlys triphylla	Achlys triphylla	Human Edible Plant
BXGF05731	Bulbophyllum protractum	Bulbophyllum protractum	Others
BXGF05747	Tarchonanthus camphoratus	Tarchonanthus camphoratus	Medicinal Plant
BXGF05756	Cistanche tubulosa	Cistanche tubulosa	Medicinal Plant
BXGF05791	Cypripedium calceolus	Cypripedium calceolus	Medicinal Plant
BXGF05849	Salacia chinensis	Salacia chinensis	Medicinal Plant
BXGF05902	Lactuca laciniata	Lactuca laciniata	Medicinal Plant
BXGF06036	Eleutherococcus gracilistylus	Eleutherococcus gracilistylus	Others
BXGF06285	Merremia umbellata	Merremia umbellata	Medicinal Plant
BXGF06306	Artemisia porrecta	Artemisia porrecta	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}