input word = C00031190

Metabolite InformationStructural formula
Name Rosmadial
(-)-Rosmadial
Formula C20H24O5
Mw 344.16237388
CAS RN 85514-31-4
C_ID C00031190 ,
InChIKey JBWRHBJFAVSAMJ-CDESSEEXNA-N
InChICode InChI=1S/C20H24O5/c1-11(2)13-8-12(9-21)15-17(16(13)23)25-18(24)20(15)7-5-6-19(3,4)14(20)10-22/h8-11,14,23H,5-7H2,1-4H3/t14-,20+/m0/s1
SMILES CC(C)c1cc(C=O)c2c(c1O)OC(=O)[C@@]21CCCC(C)(C)[C@@H]1C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeRosmarinus officinalis Ref.
PlantaeLabiataeSalvia africana-lutea Ref.
PlantaeLabiataeSalvia officinalis Ref.
PlantaeLabiataeSalvia przewalskii Ref.
zoom in