input word = C00043917

Metabolite InformationStructural formula
Name Sibiricinone A
(+)-Sibiricinone A
Formula C20H30O6
Mw 366.20423869
CAS RN 680618-59-1
C_ID C00043917 ,
InChIKey ORLJFXGZZYWOIF-QOWPFODANA-N
InChICode InChI=1S/C20H30O6/c1-11-14(22)15(23)16-18(2,3)7-5-8-19(16,4)20(11,25)9-6-12-10-13(21)26-17(12)24/h10-11,14,16-17,22,24-25H,5-9H2,1-4H3/t11-,14-,16+,17+,19+,20-/m1/s1
SMILES [C@H]1([C@H](C(=O)[C@@H]2[C@@]([C@]1(CCC1=CC(=O)O[C@@H]1O)O)(CCCC2(C)C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeLeonurus sibiricus Ref.
zoom in