input word = C00022453

Metabolite InformationStructural formula
Name 10beta-Angeloyloxy-10-desoxo-pyrrhopappolide
Formula C25H34O6
Mw 430.23553882
CAS RN 132536-49-3
C_ID C00022453 ,
InChIKey IQWVYHNJJAJYJE-SLNRLOKSNA-N
InChICode InChI=1S/C25H34O6/c1-6-15(2)22(26)30-20-7-8-21-25(5,31-21)24(20,4)11-9-16(3)18-13-19(29-23(18)27)17-10-12-28-14-17/h6,10,12,14,16,18-21H,7-9,11,13H2,1-5H3/b15-6-/t16-,18-,19-,20+,21-,24+,25-/m1/s1
SMILES C1[C@@H]2[C@]([C@]([C@H](C1)OC(=O)/C(=C\C)/C)(CC[C@H]([C@@H]1C(=O)O[C@H](C1)c1ccoc1)C)C)(O2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeConyza pyrifolia Ref.
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OrganismConyza pyrifolia
ReferenceZdero,Phytochem.,29,(1990),3167