input word = C00022392

Metabolite InformationStructural formula
Name Leonotin
Formula C20H28O5
Mw 348.193674
CAS RN 26549-00-8
C_ID C00022392 ,
InChIKey FJNCXZZQNBKEJT-SBCKHOEMNA-N
InChICode InChI=1S/C20H28O5/c1-17-7-4-8-18(2)15(17)14(25-16(17)21)11-19(3,22)20(18,23)9-5-13-6-10-24-12-13/h6,10,12,14-15,22-23H,4-5,7-9,11H2,1-3H3/t14-,15+,17+,18+,19+,20+/m1/s1
SMILES C1C[C@@]2(C(=O)O[C@@H]3C[C@]([C@@]([C@@](C1)([C@H]23)C)(CCc1cocc1)O)(C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeLeonotis dysophylla Ref.
PlantaeLabiataeLeonotis nepetaefolia Ref.
PlantaeLabiataeLeonurus sibiricus L. Ref.
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OrganismLeonotis nepetaefolia
Referencekaplan,J. Chem. Soc. C,(1970),1656