Mangiferin

Details

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Internal ID 2dc915c7-0bf8-4c98-b08a-77438beac7ea
Taxonomy Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Xanthones
IUPAC Name 1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]xanthen-9-one
SMILES (Canonical) C1=C2C(=CC(=C1O)O)OC3=C(C2=O)C(=C(C(=C3)O)C4C(C(C(C(O4)CO)O)O)O)O
SMILES (Isomeric) C1=C2C(=CC(=C1O)O)OC3=C(C2=O)C(=C(C(=C3)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
InChI InChI=1S/C19H18O11/c20-4-11-15(25)17(27)18(28)19(30-11)12-8(23)3-10-13(16(12)26)14(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,15,17-23,25-28H,4H2/t11-,15-,17+,18-,19+/m1/s1
InChI Key AEDDIBAIWPIIBD-ZJKJAXBQSA-N
Popularity 615 references in papers

Physical and Chemical Properties

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Molecular Formula C19H18O11
Molecular Weight 422.30 g/mol
Exact Mass 422.08491139 g/mol
Topological Polar Surface Area (TPSA) 197.00 Ų
XlogP -0.40

Synonyms

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4773-96-0
Chinonin
Alpizarin
Hedysarid
Chinomin
Aphloiol
Alpizarine
Shamimin
UNII-1M84LD0UMD
1M84LD0UMD
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Mangiferin

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
CHEMBL5573 P09923 Intestinal alkaline phosphatase 262 nM
IC50
via Super-PRED

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 99.41% 91.11%
CHEMBL1806 P11388 DNA topoisomerase II alpha 95.45% 89.00%
CHEMBL2581 P07339 Cathepsin D 94.53% 98.95%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 90.84% 95.56%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 88.64% 94.00%
CHEMBL3401 O75469 Pregnane X receptor 87.32% 94.73%
CHEMBL3880 P07900 Heat shock protein HSP 90-alpha 83.29% 96.21%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 80.03% 99.23%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Aconitum burnatii
Adenopeltis serrata
Ageratina adenophora
Alnus firma
Aloysia citrodora
Alseodaphne paludosa
Anemarrhena asphodeloides
Annona impressivenia
Aquilaria sinensis
Artemisia montana
Asplenium montanum
Astragalus mongholicus
Bersama abyssinica
Bersama yangambiensis
Bituminaria bituminosa
Boehmeria nivea
Caloncoba echinata
Calophyllum apetalum
Canscora alata
Castanopsis sclerophylla
Centaurea seridis
Chrozophora tinctoria
Cneorum pulverulentum
Conocephalum japonicum
Cordylanthus kingii
Cratoxylum cochinchinense
Cratoxylum formosum subsp. pruniflorum
Crocus flavus subsp. flavus
Crotalaria micans
Croton cascarilloides
Croton poilanei
Cyclopia intermedia
Cyclopia subternata
Cystopteris fragilis
Dalbergia stipulacea
Dasymaschalon sootepense
Davallia solida
Delairea odorata
Delphinium ajacis
Delphinium oliverianum
Dictyoloma vandellianum
Disynaphia halimifolia
Drypetes molunduana
Elaeagnus commutata
Eragrostis viscosa
Eucalyptus flocktoniae
Euonymus sachalinensis
Euphorbia makinoi
Felicia erigeroides
Flindersia brayleyana
Flueggea virosa subsp. melanthesoides
Forsteronia refracta
Fridericia chica
Fridericia patellifera
Fridericia samydoides
Gentiana asclepiadea
Gentiana cruciata
Gentiana lutea
Gentiana thunbergii
Gentianella campestris
Gentianella nitida
Gnidia involucrata
Grewia mollis
Guatteria megalophylla
Gymnocarpium robertianum
Gyrinops walla
Hedysarum alpinum
Hedysarum branthii
Hedysarum denticulatum
Hedysarum vicioides subsp. japonicum
Heliotropium floridum
Heptaptera triquetra
Heracleum sphondylium
Heterotheca grandiflora
Hibiscus liliastrum
Hovenia acerba
Hymenophyllum nephrophyllum
Hypericum androsaemum
Hypericum hircinum
Hypericum humifusum
Hypericum perforatum
Hypericum sampsonii
Iris domestica
Iris ensata
Iris florentina
Iris missouriensis
Iris nigricans
Jaborosa caulescens
Juglans nigra
Jungermannia obovata
Kaempferia marginata
Kaunia saltensis
Kummerowia striata
Lophozia barbata
Lupinus paniculatus
Lycoris traubii
Lygodium flexuosum
Mangifera indica
Mascarenhasia arborescens
Meconopsis napaulensis
Merremia umbellata
Millettia conraui
Monnina emarginata
Nauclea officinalis
Palafoxia rosea
Panax ginseng
Pedicularis condensata
Perityle vaseyi
Peucedanum longifolium
Phaleria capitata
Phoebe formosana
Piloselloides hirsuta
Plectranthus garckeanus
Polygala fallax
Polygala sibirica
Polygala tenuifolia
Porella swartziana
Pyrrosia hastata
Pyrrosia lingua
Pyrrosia petiolosa
Pyrus calleryana
Quercus mongolica
Rheum webbianum
Rhynchosia suaveolens
Ruta pinnata
Saccharum spontaneum
Salacia chinensis
Salacia reticulata
Salvia coulteri
Salvia dorrii
Satureja cuneifolia
Senecio flavus
Sida cordifolia
Silene fortunei
Smilax bracteata
Smilax myosotiflora
Solanum sisymbriifolium
Sophora flavescens var. flavescens
Stevia polycephala
Strychnos staudtii
Swertia calycina
Swertia chirata
Swertia cordata
Swertia corymbosa
Swertia franchetiana
Swertia japonica
Swertia kouitchensis
Swertia mussotii
Swertia pseudochinensis
Swertia punctata
Teucrium cubense
Teucrium leucocladum
Thymbra spicata
Thymus piperella
Tigridia orthantha
Trichilia rubescens
Trichomanes polypodioides
Tripterospermum japonicum
Tripterospermum lanceolatum
Tsuga mertensiana
Turraeanthus mannii
Uraria picta
Urena lobata
Wettsteinia inversa
Woodsia ilvensis

Cross-Links

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PubChem 5281647
NPASS NPC228383
ChEMBL CHEMBL464825
LOTUS LTS0009443
wikiData Q1074417