input word = C00035077

Metabolite InformationStructural formula
Name delta-Tocotrienol
Formula C27H40O2
Mw 396.30283052
CAS RN 25612-59-3
C_ID C00035077 ,
InChIKey ODADKLYLWWCHNB-QLRHFBJSNA-N
InChICode InChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h10,12,14,18-19,28H,7-9,11,13,15-17H2,1-6H3/b21-12+,22-14+/t27-/m1/s1
SMILES CC(C)=CCC/C(C)=C/CC/C(C)=C/CC[C@]1(C)CCc2cc(O)cc(C)c2O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeAmaranthus hypochondriacus L. Ref.
PlantaeApiaceaeCarum carvi L. Ref.
PlantaeApiaceaeCoriandrum sativum L. Ref.
PlantaeApiaceaeFoeniculum vulgare L. Ref.
PlantaeBixaceaeBixa orellana L. Ref.
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum inophyllum L. Ref.
PlantaeCanellaceaeCinnamosma fragrans Ref.
PlantaeCanellaceaeCinnamosma macrocarpa Ref.
PlantaeCanellaceaeCinnamosma madagascariensis Ref.
PlantaeCanellaceaePleodendron costaricense Ref.
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia multiflora Ref.
PlantaeCruciferaeBrassica rapa Ref.
PlantaeEricaceaeVaccinium macrocarpon Aiton Ref.
PlantaeEuphorbiaceaeHevea brasiliensis Mull.Arg. Ref.
PlantaeHypericaceaeCratoxylum sumatranum Ref.
PlantaeJuglandaceaeJuglans regia L. Ref.
PlantaeLabiataeRosmarinus officinalis L. Ref.
PlantaePalmaeCocos nucifera L. Ref.
PlantaePalmaeElaeis guineensis Jacq. Ref.
PlantaePoaceaeAvena sativa L. Ref.
PlantaePoaceaeHordeum vulgare L. Ref.
PlantaePoaceaeOryza sativa L. Ref.
PlantaePoaceaeZea mays L. Ref.
PlantaeSapindaceaeAesculus hippocastanum Hort. Ref.
PlantaeSapindaceaeLitchi chinensis Sonn. Ref.
PlantaeSolanaceaeNicotiana tabacum L. Ref.
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OrganismVaccinium macrocarpon Aiton
ReferenceHorvath,Phytochem.,67,(2006),1185