input word = C00046566

Metabolite InformationStructural formula
Name 19-Deacetylteuscorodol
(-)-19-Deacetylteuscorodol
Formula C20H26O6
Mw 362.17293856
CAS RN 106092-19-7
C_ID C00046566 ,
InChIKey GLNIOASGXMEGTM-YHVRGQTDNA-N
InChICode InChI=1S/C20H26O6/c1-12-7-17(23)20(11-22)14(9-21)3-2-4-16(20)19(12)8-15(26-18(19)24)13-5-6-25-10-13/h3,5-6,10,12,15-17,21-23H,2,4,7-9,11H2,1H3/t12-,15+,16-,17-,19-,20+/m1/s1
SMILES C[C@@H]1C[C@@H](O)[C@@]2(CO)C(CO)=CCC[C@@H]2[C@@]12C[C@@H](c1ccoc1)OC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeTeucrium botrys L. Ref.
PlantaeLabiataeTeucrium maghrebinum Ref.
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