input word = C00021172

Metabolite InformationStructural formula
Name 4-Acetylchamissonolide
Formula C19H26O7
Mw 366.16785319
CAS RN 128386-02-7
C_ID C00021172 ,
InChIKey QFJNAUKGMNMIGV-DCVZNUDUNA-N
InChICode InChI=1S/C19H26O7/c1-8-6-12-15(9(2)18(23)26-12)17(22)19(5)14(25-11(4)21)7-13(16(8)19)24-10(3)20/h8,12-17,22H,2,6-7H2,1,3-5H3/t8-,12-,13+,14-,15+,16-,17+,19-/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@H](C)[C@@H]3[C@@H](OC(C)=O)C[C@@H](OC(C)=O)[C@@]3(C)[C@@H](O)[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHymenoxys scaposa Ref.
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OrganismHymenoxys scaposa
ReferenceGao,Phytochem.,29,(1990),895