input word = C00020487

Metabolite InformationStructural formula
Name [3aS-(3aalpha,4alpha,5alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid
Formula C21H24O6
Mw 372.1572885
CAS RN 72635-04-2
C_ID C00020487 ,
InChIKey HUMCSDURJLRDAG-DLOHBLOYNA-N
InChICode InChI=1S/C21H24O6/c1-9(2)20(23)27-19-16-12(5)21(24)26-18(16)15-10(3)7-8-14(15)11(4)17(19)25-13(6)22/h7-9,15-19H,3,5H2,1-2,4,6H3/t15-,16+,17-,18+,19+/m0/s1
SMILES C1(=O)C(=C)[C@@H]2[C@H](O1)[C@@H]1C(=C([C@@H]([C@@H]2OC(=O)C(C)C)OC(=O)C)C)C=CC1=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAthanasia montana Ref.
zoom in