input word = C00010600

Metabolite InformationStructural formula
Name Ajugol
Leonuride
Formula C15H24O9
Mw 348.14203237
CAS RN 52949-83-4
C_ID C00010600 ,
InChIKey VELYAQRXBJLJAK-DDXUWRRDNA-N
InChICode InChI=1S/C15H24O9/c1-15(21)4-7(17)6-2-3-22-13(9(6)15)24-14-12(20)11(19)10(18)8(5-16)23-14/h2-3,6-14,16-21H,4-5H2,1H3/t6-,7-,8-,9-,10-,11+,12+,13+,14-,15+/m1/s1
SMILES [C@@H]12[C@H]([C@@H](OC=C1)O[C@H]1O[C@@H]([C@H]([C@@H]([C@@H]1O)O)O)CO)[C@](C[C@H]2O)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAsystasia gangetica L. Ref.
PlantaeAcanthaceaeAsystasia intrusa Ref.
PlantaeBignoniaceaeKigelia pinnata DC. Ref.
PlantaeBignoniaceaeMarkhamia stipulata Ref.
PlantaeBignoniaceaeStereospermum cylindricum Ref.
PlantaeCelastraceaeMaytenus loevis Ref.
PlantaeLabiataeAjuga reptans Ref.
PlantaeLabiataeLeonurus cardiaca Ref.
PlantaeLabiataeMelittis melissophyllum Ref.
PlantaeOrobanchaceaeCistanche tubulosa Ref.
PlantaePlantaginaceaeVeronicastrum sibiricum (L.) Pennell Ref.
PlantaePlantaginaceaeVeronicastrum virginicum (L.) Farw. Ref.
PlantaeScrophulariaceaeScrophularia lepidota Ref.
PlantaeScrophulariaceaeTriaenophora rupestris Ref.
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OrganismVeronicastrum sibiricum (L.) Pennell
ReferenceTaskova,Phytochem.,67,(2006),286