acompound

Showing entry for Cyclolariciresinol

General Compound Information
BXGC Id	BXGC0000106
Compound Name	Cyclolariciresinol
Structure
Formula	C20H24O6
InchiKey	OGFXBIXJCWAUCH-KPHUOKFYSA-N
SMILES	COC1=CC2=C(C=C1O)[C@@H]([C@@H](CO)[C@H](CO)C2)C1=CC=C(O)C(OC)=C1
Inchi	InChI=1S/C20H24O6/c1-25-18-6-11(3-4-16(18)23)20-14-8-17(24)19(26-2)7-12(14)5-13(9-21)15(20)10-22/h3-4,6-8,13,15,20-24H,5,9-10H2,1-2H3/t13-,15-,20-/m0/s1
IUPAC	(6R,7R,8S)-8-(4-hydroxy-3-methoxyphenyl)-6,7-bis(hydroxymethyl)-3-methoxy-5,6,7,8-tetrahydronaphthalen-2-ol
Molecular Weight	360.4
Pubchem Id	160521
Chembl Id	CHEMBL399512

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

50223783

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	BXGT006700	Aldo-keto reductase family 1 member B1	reviewed		Akr1b1	-	>100000	-	-
reviewed	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	-	>100000	-	-
reviewed	BXGT007595	Cytochrome P450 2D6	reviewed		CYP2D6	-	97700	-	-

CHEMBL

CHEMBL399512

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
P10635	BXGT007595	Cytochrome P450 2D6	reviewed	-	CYP2D6	IC50	'='	97700	nM
P08684	BXGT006812	Cytochrome P450 3A4	reviewed	Enzyme	CYP3A4	IC50	'>'	100000	nM
P07943	BXGT006700	Aldo-keto reductase family 1 member B1	reviewed	-	Akr1b1	IC50	'>'	100000	nM
P07943	BXGT006700	Aldo-keto reductase family 1 member B1	reviewed	-	Akr1b1	Inhibition	'='	36	%

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00101	Flaxseed	Linum usitatissimum	Herbs and Spices
BXGF00151	Pomegranate	Punica granatum	Fruits
BXGF00170	Sesame	Sesamum orientale	Herbs and Spices
BXGF00352	Japanese chestnut	Castanea crenata	Nuts
BXGF01003	Carpobrotus edulis	Carpobrotus edulis	Medicinal Plant
BXGF01011	Clematis hexapetala	Clematis hexapetala	Human Edible Plant
BXGF01062	Asplenium normale	Asplenium normale	Others
BXGF01137	Centrolobium tomentosum	Centrolobium tomentosum	Others
BXGF01196	Elaeagnus commutata	Elaeagnus commutata	Medicinal Plant
BXGF01201	Psilostrophe cooperi	Psilostrophe cooperi	Others
BXGF01222	Ocimum tenuiflorum	Ocimum tenuiflorum	Medicinal Plant
BXGF01263	Adenopeltis colliguaya	Adenopeltis colliguaya	Others
BXGF01305	Trifolium alexandrinum	Trifolium alexandrinum	Medicinal Plant
BXGF01357	Ampelopsis japonica	Ampelopsis japonica	Medicinal Plant
BXGF01359	Daphne feddei	Daphne feddei	Others
BXGF01372	Quercus mongolica	Quercus mongolica	Medicinal Plant
BXGF01374	Balanops australiana	Balanops australiana	Others
BXGF01380	Cneorum pulverulentum	Cneorum pulverulentum	Medicinal Plant
BXGF01446	Perityle vaseyi	Perityle vaseyi	Others
BXGF01507	Sideritis tragoriganum	Sideritis tragoriganum	Others
BXGF01566	Pedicularis condensata	Pedicularis condensata	Others
BXGF01605	Palafoxia rosea	Palafoxia rosea	Others
BXGF01643	Chrozophora obliqua	Chrozophora obliqua	Medicinal Plant
BXGF01696	Coptis japonica	Coptis japonica	Medicinal Plant
BXGF01717	Senecio flavus	Senecio flavus	Medicinal Plant
BXGF01749	Salvia coulteri	Salvia coulteri	Others
BXGF01778	Solanum jamaicense	Solanum jamaicense	Others
BXGF01855	Porella swartziana	Porella swartziana	Others
BXGF01895	Lippia carviodora	Lippia carviodora	Medicinal Plant
BXGF01912	Ceratophyllum submersum	Ceratophyllum submersum	Others
BXGF01936	Brucea javanica	Brucea javanica	Medicinal Plant
BXGF01948	Meconopsis napaulensis	Meconopsis napaulensis	Medicinal Plant
BXGF01968	Rheum webbianum	Rheum webbianum	Medicinal Plant
BXGF01971	Myrica nana	Myrica nana	Others
BXGF01999	Mascarenhasia arborescens	Mascarenhasia arborescens	Others
BXGF02029	Eucalyptus flocktoniae	Eucalyptus flocktoniae	Others
BXGF02057	Kummerowia striata	Kummerowia striata	Medicinal Plant
BXGF02061	Dracocephalum kotschyi	Dracocephalum kotschyi	Medicinal Plant
BXGF02112	Thymbra spicata	Thymbra spicata	Medicinal Plant
BXGF02135	Phoebe formosana	Phoebe formosana	Others
BXGF02153	Sida cordifolia	Sida cordifolia	Medicinal Plant
BXGF02197	Vitex peduncularis	Vitex peduncularis	Medicinal Plant
BXGF02240	Clematis terniflora var. mandshurica	Clematis terniflora var. mandshurica	Medicinal Plant
BXGF02258	Millettia conraui	Millettia conraui	Medicinal Plant
BXGF02278	Centaurea seridis	Centaurea seridis	Others
BXGF02293	Rubia yunnanensis	Rubia yunnanensis	Medicinal Plant
BXGF02309	Flindersia brayleyana	Flindersia brayleyana	Others
BXGF02335	Satureja cuneifolia	Satureja cuneifolia	Human Edible Plant
BXGF02358	Consolida ajacis	Consolida ajacis	Medicinal Plant
BXGF02468	Sambucus williamsii	Sambucus williamsii	Medicinal Plant
BXGF02505	Pinus sylvestris	Pinus sylvestris	Medicinal Plant
BXGF02536	Oenothera odorata	Oenothera odorata	Medicinal Plant
BXGF02706	Scenedesmus basiliensis	Scenedesmus basiliensis	Others
BXGF02802	Araiostegiella perdurans	Araiostegiella perdurans	Others
BXGF02815	Pinellia ternata	Pinellia ternata	Medicinal Plant
BXGF02956	Forsythia viridissima	Forsythia viridissima	Medicinal Plant
BXGF03253	Forsythia suspensa	Forsythia suspensa	Medicinal Plant
BXGF03476	Hylocomium splendens	Hylocomium splendens	Others
BXGF03498	Coptis deltoidea	Coptis deltoidea	Medicinal Plant
BXGF03623	Heracleum sphondylium	Heracleum sphondylium	Medicinal Plant
BXGF03666	Bituminaria bituminosa	Bituminaria bituminosa	Medicinal Plant
BXGF03702	Solanum aculeatissimum	Solanum aculeatissimum	Medicinal Plant
BXGF03763	Millettia laurentii	Millettia laurentii	Medicinal Plant
BXGF03765	Alcea rosea	Alcea rosea	Medicinal Plant
BXGF04140	Dalbergia stipulacea	Dalbergia stipulacea	Medicinal Plant
BXGF04258	Rubia cordifolia	Rubia cordifolia	Medicinal Plant
BXGF04349	Monodora tenuifolia	Monodora tenuifolia	Human Edible Plant
BXGF04542	Streblus asper	Streblus asper	Medicinal Plant
BXGF04784	Coptis teeta	Coptis teeta	Medicinal Plant
BXGF04896	Kokoona reflexa	Kokoona reflexa	Others
BXGF04918	Taxus yunnanensis	Taxus yunnanensis	Others
BXGF04962	Forsythia suspense	Forsythia suspense	Others
BXGF04966	Symplocos setchuensis	Symplocos setchuensis	Others
BXGF05080	Jungermannia obovata	Jungermannia obovata	Others
BXGF05083	Viguiera decurrens	Viguiera decurrens	Medicinal Plant
BXGF05145	Sideritis brevibracteata	Sideritis brevibracteata	Human Edible Plant
BXGF05184	Maesa ramentacea	Maesa ramentacea	Medicinal Plant
BXGF05242	Euphorbia cornigera	Euphorbia cornigera	Others
BXGF05297	Isatis tinctoria	Isatis tinctoria	Medicinal Plant
BXGF05302	Lippia sidoides	Lippia sidoides	Others
BXGF05368	Salvia yosgadensis	Salvia yosgadensis	Others
BXGF05394	Turraeanthus mannii	Turraeanthus mannii	Others
BXGF05428	Sideroxylon cubense	Sideroxylon cubense	Others
BXGF05430	Coleus garckeanus	Coleus garckeanus	Others
BXGF05490	Solanum sisymbriifolium	Solanum sisymbriifolium	Medicinal Plant
BXGF05506	Coptis chinensis	Coptis chinensis	Medicinal Plant
BXGF05519	Gerbera piloselloides	Gerbera piloselloides	Medicinal Plant
BXGF05654	Pinus strobus	Pinus strobus	Medicinal Plant
BXGF05681	Clematis chinensis	Clematis chinensis	Medicinal Plant
BXGF05693	Picea jezoensis var. jezoensis	Picea jezoensis var. jezoensis	Medicinal Plant
BXGF05730	Alpinia blepharocalyx	Alpinia blepharocalyx	Medicinal Plant
BXGF05764	Eucalyptus jenseni	Eucalyptus jenseni	Others
BXGF05849	Salacia chinensis	Salacia chinensis	Medicinal Plant
BXGF05869	Salacia lehmbachii	Salacia lehmbachii	Medicinal Plant
BXGF05954	Pluchea odorata	Pluchea odorata	Others
BXGF06033	Euonymus tingens	Euonymus tingens	Medicinal Plant
BXGF06143	Persicaria tinctoria	Persicaria tinctoria	Medicinal Plant
BXGF06272	Clematis manshurica	Clematis manshurica	Others
BXGF06285	Merremia umbellata	Merremia umbellata	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}