KNApSAcK Metabolite Information

input word = C00019308

Metabolite Information

Structural formula

Name

3-O-beta-D-Glucopyranosyl sitosterol
beta-Sitosterol glucoside
beta-sitosterol-3-beta-O-D-glucopyranoside
beta-Sitosterol-3-O-beta-D-glucoside
beta-Sitosterol 3-O-beta-D-glucopyranoside
Daucosterin
Doursterol
beta-Sitosteryl-glucoside
Daucosterol
beta-Daucosterol
beta-Sitosterol 3-O-beta-glucopyranoside
beta-Sitosteryl glucoside
Sitosterol glucoside

Formula

C35H60O6

576.43898965

CAS RN

474-58-8

C_ID

C00019308 ,

InChIKey

NPJICTMALKLTFW-ZWEMWMMCNA-N

InChICode

InChI=1S/C35H60O6/c1-7-22(20(2)3)9-8-21(4)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)40-33-32(39)31(38)30(37)29(19-36)41-33/h10,20-22,24-33,36-39H,7-9,11-19H2,1-6H3/t21-,22-,24+,25+,26-,27+,28+,29+,30-,31+,32-,33-,34+,35-/m1/s1

SMILES

CC[C@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C

Start Substs in Alk. Biosynthesis (Prediction)

Organism

Kingdom	Family	Species	Reference
Plantae	Acanthaceae	Dicliptera riparia	Ref.
Plantae	Agavaceae	Agave americana	Ref.
Plantae	Anacardiaceae	Rhus wallichi	Ref.
Plantae	Annonaceae	Annona purpurea	Ref.
Plantae	Annonaceae	Artabotrys uncinatus	Ref.
Plantae	Apiaceae	Ferula persica	Ref.
Plantae	Apiaceae	Heracleum granatense	Ref.
Plantae	Apocynaceae	Cryptolepis obtusa	Ref.
Plantae	Araliaceae	Centella asiatica	Ref.
Plantae	Araliaceae	Hedera nepalensis K.Koch	Ref.
Plantae	Araliaceae	Panax notoginseng	Ref.
Plantae	Araliaceae	Schefflera capitata Harms.	Ref.
Plantae	Aristolochiaceae	Aristolochia heterophylla	Ref.
Plantae	Aristolochiaceae	Aristolochia kaempferi	Ref.
Plantae	Asparagaceae	Asparagus officinalis	Ref.
Plantae	Asteraceae	Achillea ageratum	Ref.
Plantae	Asteraceae	Ajania fruticulosa	Ref.
Plantae	Asteraceae	Artemisia minor	Ref.
Plantae	Asteraceae	Artemisia sieversiana	Ref.
Plantae	Asteraceae	Centaurea bracteata Scop.	Ref.
Plantae	Asteraceae	Eupatorium adenophorum	Ref.
Plantae	Asteraceae	Eupatorium macrocephalum Lee.	Ref.
Plantae	Asteraceae	Gonospermum elegans	Ref.
Plantae	Asteraceae	Inula cappa	Ref.
Plantae	Asteraceae	Inula racemosa	Ref.
Plantae	Asteraceae	Inula viscosa	Ref.
Plantae	Asteraceae	Robinsonecio gerberifolius	Ref.
Plantae	Asteraceae	Senecio chionophilus	Ref.
Plantae	Asteraceae	Taraxacum formosanum	Ref.
Plantae	Asteraceae	Viguiera decurrens	Ref.
Plantae	Balanophoraceae	Balanophora abbreviata B1	Ref.
Plantae	Begoniaceae	Begonia nantoensis	Ref.
Plantae	Berberidaceae	Berberis pseudanubalata	Ref.
Plantae	Bignoniaceae	Newbouldia laevis	Ref.
Plantae	Blechnaceae	Stenochlaena palustris	Ref.
Plantae	Canellaceae	Canella winterana	Ref.
Plantae	Capparaceae	Capparis aegyptia	Ref.
Plantae	Capparaceae	Capparis deserti	Ref.
Plantae	Capparaceae	Capparis leucophylla	Ref.
Plantae	Cecropiaceae	Myrianthus arboreus	Ref.
Plantae	Celastraceae	Tripterygium wilfordii	Ref.
Plantae	Clusiaceae/Clusiaceae-Guttiferae	Clusia nemorosa	Ref.
Plantae	Clusiaceae/Clusiaceae-Guttiferae	Garcinia griffithii	Ref.
Plantae	Combretaceae	Combretum quadrangulare	Ref.
Plantae	Connaraceae	Rourea minor	Ref.
Plantae	Convallariaceae	Disporopsis aspera	Ref.
Plantae	Convolvulaceae	Erycibe expansa	Ref.
Plantae	Convolvulaceae	Pharbitis nil	Ref.
Plantae	Cruciferae	Raphanus sativus	Ref.
Plantae	Cucurbitaceae	Gymnopetalum integrifolium	Ref.
Plantae	Cupressaceae	Chamaecyparis formosensis	Ref.
Plantae	Dennstaedtiaceae	Pteridium aquilinum	Ref.
Plantae	Dioscoreaceae	Dioscorea spongiosa	Ref.
Plantae	Dryopteridaceae	Dryopteris crassirhizoma	Ref.
Plantae	Ebenaceae	Diospyros rhodocalyx	Ref.
Plantae	Ephedraceae	Ephedra sinica	Ref.
Plantae	Euphorbiaceae	Alchornea cordifolia	Ref.
Plantae	Euphorbiaceae	Croton lechleri Mull.Arg.	Ref.
Plantae	Euphorbiaceae	Croton urucurana Baill.	Ref.
Plantae	Euphorbiaceae	Euphorbia boetica	Ref.
Plantae	Euphorbiaceae	Euphorbia lanata	Ref.
Plantae	Euphorbiaceae	Euphorbia tinctoria	Ref.
Plantae	Fabaceae	Cassia javanica	Ref.
Plantae	Fabaceae	Centrosema pubescens	Ref.
Plantae	Fabaceae	Millettia conraui	Ref.
Plantae	Fabaceae	Millettia pinnata	Ref.
Plantae	Fabaceae	Piptadenia macrocarpa	Ref.
Plantae	Fabaceae	Saraca asoca	Ref.
Plantae	Fabaceae	Swartzia brachyrachis	Ref.
Plantae	Fabaceae	Trifolium resupinatum	Ref.
Plantae	Gentianaceae	Gentiana lutea L.	Ref.
Plantae	Geraniaceae	Geranium macrorrhizum L.	Ref.
Plantae	Geraniaceae	Pelargonium reniforme	Ref.
Plantae	Gnetaceae	Gnetum cleistostachyum	Ref.
Plantae	Gnetaceae	Gnetum pendulum C.Y.	Ref.
Plantae	Hydrangeaceae	Hydrangea chinensis	Ref.
Plantae	Hydrangeaceae	Pileostegia viburnoides var. glabrescens	Ref.
Plantae	Hydrocharitaceae	Enhalus acoroides	Ref.
Plantae	Hypoxidaceae	Curculigo capitulata	Ref.
Plantae	Labiatae	Callicarpa macrophylla	Ref.
Plantae	Labiatae	Hyptis brevipes	Ref.
Plantae	Labiatae	Isodon phyllostachys	Ref.
Plantae	Labiatae	Salvia aethiopis	Ref.
Plantae	Labiatae	Salvia canariensis L.	Ref.
Plantae	Labiatae	Satureja acinos	Ref.
Plantae	Labiatae	Schnabelia tetradonta	Ref.
Plantae	Labiatae	Vitex trifolia	Ref.
Plantae	Lauraceae	Beilschmiedia zenkeri	Ref.
Plantae	Lauraceae	Cinnamomum camphora	Ref.
Plantae	Lauraceae	Machilus zuihoensis	Ref.
Plantae	Loranthaceae	Psittacanthus cucullaris	Ref.
Plantae	Lythraceae	Punica granatum	Ref.
Plantae	Magnoliaceae	Magnolia obovata	Ref.
Plantae	Malvaceae	Hibiscus taiwanensis	Ref.
Plantae	Melanthiaceae	Veratrum album	Ref.
Plantae	Meliaceae	Aglaia rubiginosa	Ref.
Plantae	Meliaceae	Cipadessa cinerascens	Ref.
Plantae	Meliaceae	Khaya anthotheca	Ref.
Plantae	Meliaceae	Toona sinensis	Ref.
Plantae	Meliaceae	Xylocarpus granatum	Ref.
Plantae	Melianthaceae	Melianthus major	Ref.
Plantae	Menispermaceae	Macrococculus pomiferus	Ref.
Plantae	Moraceae	Ficus septica	Ref.
Plantae	Moraceae	Morus insignis	Ref.
Plantae	Moringaceae	Moringa oleifera	Ref.
Plantae	Moringaceae	Moringa peregrina	Ref.
Plantae	Myrsinaceae	Embelia ribes Burm.	Ref.
Plantae	Myrtaceae	Eucalyptus camaldulensis var.obtusa	Ref.
Plantae	Myrtaceae	Eugenia sandwicensis	Ref.
Plantae	Myrtaceae	Psidium guajava	Ref.
Plantae	Myrtaceae	Syzygium aromaticum	Ref.
Plantae	Orchidaceae	Dendrobium nobile Lindl.	Ref.
Plantae	Paeoniaceae	Paeonia suffruticosa	Ref.
Plantae	Palmae	Borassus flabellifer	Ref.
Plantae	Phyllanthaceae	Phyllanthus oligospermus	Ref.
Plantae	Picramniaceae	Picramnia latifolia	Ref.
Plantae	Piperaceae	Piper nigrum L.	Ref.
Plantae	Piperaceae	Piper umbellatum	Ref.
Plantae	Plumbaginaceae	Plumbago zeylanica	Ref.
Plantae	Polygonaceae	Rumex nepalensis	Ref.
Plantae	Primulaceae	Primula macrophylla	Ref.
Plantae	Pteridaceae	Pteris multifida	Ref.
Plantae	Rosaceae	Chaenomeles japonica	Ref.
Plantae	Rosaceae	Rubus ellipticus	Ref.
Plantae	Rosaceae	Spiraea formosana	Ref.
Plantae	Rubiaceae	Chione venosa (sw.) Urban var.venosa	Ref.
Plantae	Rubiaceae	Mitragyna inermis	Ref.
Plantae	Rubiaceae	Mitragyna rotundifolia	Ref.
Plantae	Rubiaceae	Mitragyna speciosa	Ref.
Plantae	Rubiaceae	Mitragyna stipulosa	Ref.
Plantae	Rubiaceae	Morinda citrifolia	Ref.
Plantae	Rubiaceae	Morinda officinalis	Ref.
Plantae	Rubiaceae	Ophiorrhiza liukiuensis	Ref.
Plantae	Rutaceae	Citrus reticulata	Ref.
Plantae	Rutaceae	Zanthoxylum armatum	Ref.
Plantae	Santalaceae	Viscum coloratum	Ref.
Plantae	Schisandraceae	Kadsura heteroclita	Ref.
Plantae	Scrophulariaceae	Scrophularia ningpoensis	Ref.
Plantae	Smilacaceae	Smilax china	Ref.
Plantae	Solanaceae	Hyoscyamus niger	Ref.
Plantae	Solanaceae	Solanum melongena	Ref.
Plantae	Solanaceae	Withania somnifera	Ref.
Plantae	Stilbaceae	Nuxia sphaerocephala	Ref.
Plantae	Taxaceae	Taxus wallichiana	Ref.
Plantae	Trochodendraceae/Tetracentraceae	Tetracentron sinense	Ref.
Plantae	Verbenaceae	Lantana camara	Ref.
Plantae	Verbenaceae	Verbena brasiliensis VELL	Ref.
Plantae	Verbenaceae	Verbena officinalis	Ref.
Plantae	Zingiberaceae	Alpinia blepharocalyx	Ref.
Plantae	Zingiberaceae	Alpinia pinnanensis	Ref.
Plantae	Zingiberaceae	Zingiber aromaticum	Ref.
Plantae	Zingiberaceae	Zingiber officinale	Ref.
Plantae	Zygophyllaceae	Tribulus terrestris	Ref.
-	-	Aceraceae nikoense	Ref.
-	-	Moghania macrophylla	Ref.

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Organism	Magnolia obovata
Reference	Youn,Chem.Pharm.Bull.,56,(2008),115