input word = C00033609

Metabolite InformationStructural formula
Name 9-O-Acetylanthemolide B
Formula C17H22O8
Mw 354.13146768
CAS RN 198065-72-4
C_ID C00033609 ,
InChIKey OQNCVYGKABLVLD-JFMJXFNINA-N
InChICode InChI=1S/C17H22O8/c1-7-10-12(19)14(23-8(2)18)17(4,21)9-5-6-16(3,25-22)11(9)13(10)24-15(7)20/h5-6,9-14,19,21-22H,1H2,2-4H3/t9-,10-,11-,12+,13+,14+,16-,17-/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@@H](O)[C@@H](OC(C)=O)[C@@](C)(O)[C@@H]1C=C[C@@](C)(OO)[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAnthemis carpatica Ref.
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