input word = C00020851

Metabolite InformationStructural formula
Name [3aS-(3aalpha,5alpha,6alpha,6aalpha,8alpha,9bbeta)]-3a,4,5,6,6a,7,8,9b-Octahydro-5,6,8-trihydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2(3H)-one
Formula C15H20O5
Mw 280.13107375
CAS RN 128366-58-5
C_ID C00020851 ,
InChIKey DPYNIKWDGAULLI-DKGFXLPRNA-N
InChICode InChI=1S/C15H20O5/c1-6-8-4-11(17)15(3,19)9-5-10(16)7(2)12(9)13(8)20-14(6)18/h8-11,13,16-17,19H,1,4-5H2,2-3H3/t8-,9+,10-,11+,13-,15-/m0/s1
SMILES [C@@H]12C(=C([C@H](C2)O)C)[C@@H]2[C@@H](C[C@H]([C@@]1(C)O)O)C(=C)C(=O)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAjania achilleoides Ref.
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