input word = C00010595

Metabolite InformationStructural formula
Name Caryoptoside
Formula C17H26O11
Mw 406.14751167
CAS RN 139687-24-4
C_ID C00010595 ,
InChIKey VIXATJMNFXMPDC-XZZKSORYNA-N
InChICode InChI=1S/C17H26O11/c1-17(24)9(19)3-6-7(14(23)25-2)5-26-15(10(6)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5-6,8-13,15-16,18-22,24H,3-4H2,1-2H3/t6-,8-,9+,10-,11-,12+,13+,15+,16-,17+/m1/s1
SMILES [C@H]12[C@H]([C@@H](OC=C1C(=O)OC)O[C@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)CO)[C@]([C@H](C2)O)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeLamium purpureum L. Ref.
PlantaeOrobanchaceaePedicularis muscicola Ref.
PlantaePlantaginaceaePlantago sempervirens Ref.
PlantaeVerbenaceaeLippia alba Ref.
PlantaeVerbenaceaeLippia graveolens Ref.
--Caryoteris sp. Ref.
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OrganismLippia alba
ReferenceHennebelle,J.Ethnopharmacol.,116,(2008),211