input word = C00010685

Metabolite InformationStructural formula
Name Sesamoside
Formula C17H24O12
Mw 420.12677623
CAS RN 117479-87-5
C_ID C00010685 ,
InChIKey XZVXEPPPQBLGMQ-YLHHPTOENA-N
InChICode InChI=1S/C17H24O12/c1-16-10-15(28-14-9(21)8(20)7(19)6(3-18)27-14)26-4-5(13(23)25-2)17(10,24)11(22)12(16)29-16/h4,6-12,14-15,18-22,24H,3H2,1-2H3/t6-,7+,8+,9-,10+,11+,12-,14-,15-,16+,17-/m0/s1
SMILES [C@]12([C@@H]([C@@]3([C@H]([C@H]1O)O3)C)[C@@H](OC=C2C(=O)OC)O[C@@H]1O[C@H]([C@H]([C@H]([C@@H]1O)O)O)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeLamium garganicum Ref.
PlantaeLabiataePhlomis mongolica Ref.
PlantaeLabiataePhlomis muscicola Ref.
PlantaeOrobanchaceaePedicularis muscicola Ref.
PlantaePedaliaceaeSesamum angolense Ref.
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OrganismLamium garganicum
ReferenceAlipieva,Phytochem.,64,(2003),1413