input word = C00020789

Metabolite InformationStructural formula
Name [3aR-[3aalpha,4beta(R*),9aalpha,9bbeta]]-2,5-Dihydro-5-hydroxy-2,3,3a,4,5,7,9a,9b-octahydro-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 3-furancarboxylic acid
Formula C20H22O6
Mw 358.14163844
CAS RN 100045-37-2
C_ID C00020789 ,
InChIKey VZISNPAYLUAVSJ-MYCYKVFSNA-N
InChICode InChI=1S/C20H22O6/c1-9-4-5-13-10(2)6-14(25-20(23)12-7-15(21)24-8-12)17-11(3)19(22)26-18(17)16(9)13/h4,7,14-18,21H,3,5-6,8H2,1-2H3/t14-,15+,16+,17-,18-/m1/s1
SMILES C12=C(C[C@H]([C@@H]3[C@@H]([C@H]1C(=CC2)C)OC(=O)C3=C)OC(=O)C1=C[C@H](OC1)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeStevia mercedensis Ref.
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