input word = C00050357

Metabolite InformationStructural formula
Name Excisanin F
(+)-Excisanin F
Formula C20H28O6
Mw 364.18858863
CAS RN 196706-24-8
C_ID C00050357 ,
InChIKey JNCNFZJCIOPIJA-IRUIMROYNA-N
InChICode InChI=1S/C20H28O6/c1-10-11-3-4-12-19(9-22)13(18(2,8-21)6-5-14(19)23)7-15(24)20(12,16(10)25)17(11)26/h8,11-15,17,22-24,26H,1,3-7,9H2,2H3/t11-,12-,13+,14-,15+,17+,18+,19-,20-/m0/s1
SMILES [C@@H]1([C@]23[C@@H](C[C@@H]4[C@@](CC[C@@H]([C@]4([C@@H]2CC[C@H]1C(=C)C3=O)CO)O)(C)C=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon excisa Ref.
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OrganismIsodon excisa
ReferenceWang,J.Nat.Prod.,60,(1997),1161