input word = C00039731

Metabolite InformationStructural formula
Name Mandarone C
(+)-Mandarone C
Formula C20H20O4
Mw 324.13615913
CAS RN 246511-73-9
C_ID C00039731 ,
InChIKey IIOBFLRWFIJSIZ-GNLPSFAGNA-N
InChICode InChI=1S/C20H20O4/c1-10-8-11-16(22)14-12(21)9-13-19(2,3)6-5-7-20(13,4)15(14)17(23)18(11)24-10/h5-6,8-9,22-23H,7H2,1-4H3/t20-/m0/s1
SMILES c12c(C(=O)C=C3[C@@]1(CC=CC3(C)C)C)c(c1c(c2O)oc(c1)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeClerodendrum mandarinorum Diels Ref.
zoom in