input word = C00011833

Metabolite InformationStructural formula
Name Isouvedalin
Formula C23H28O9
Mw 448.17333249
CAS RN 74635-71-5
C_ID C00011833 ,
InChIKey DTOQMTITXRDCDA-QKMPTDGSNA-N
InChICode InChI=1S/C23H28O9/c1-11-8-7-9-15(21(26)28-6)18(31-22(27)23(5)13(3)32-23)19(29-14(4)24)17-12(2)20(25)30-16(17)10-11/h9-10,13,16-19H,2,7-8H2,1,3-6H3/b11-10-,15-9+/t13-,16+,17+,18+,19-,23-/m1/s1
SMILES C=C1C(=O)O[C@@H]2/C=C(C)CC/C=C(/C(=O)OC)[C@H](OC(=O)[C@]3(C)O[C@@H]3C)[C@@H](OC(C)=O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSmallanthus uvedalius Ref.
zoom in