input word = C00020820

Metabolite InformationStructural formula
Name Acetoxyachillin
8-Hydroxyachillin acetate
Formula C17H20O5
Mw 304.13107375
CAS RN 35866-60-5
C_ID C00020820 ,
InChIKey QONYNSMAVSRIRD-IVGGGWCONA-N
InChICode InChI=1S/C17H20O5/c1-7-5-11(19)13-8(2)6-12(21-10(4)18)15-9(3)17(20)22-16(15)14(7)13/h5,9,12,14-16H,6H2,1-4H3/t9-,12+,14+,15-,16-/m1/s1
SMILES C12=C(C[C@@H]([C@@H]3[C@@H]([C@H]1C(=CC2=O)C)OC(=O)[C@@H]3C)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea lanulosa Ref.
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OrganismAchillea lanulosa
ReferenceWhite,Tetrahedron Lett.,3,(1963),137