input word = C00021277

Metabolite InformationStructural formula
Name 3-Oxo-4,11(13)-ivaxallaradien-12-oic acid
Formula C15H18O3
Mw 246.12559444
CAS RN 125289-97-6
C_ID C00021277 ,
InChIKey XVOIFWMPUWNRJT-WLGDLSNSNA-N
InChICode InChI=1S/C15H18O3/c1-7-9-4-10(8(2)14(17)18)12-6-15(12,3)11(9)5-13(7)16/h10-12H,2,4-6H2,1,3H3,(H,17,18)/t10-,11-,12-,15+/m1/s1
SMILES C=C(C(=O)O)[C@H]1CC2=C(C)C(=O)C[C@H]2[C@]2(C)C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGeigeria plumosa Ref.
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OrganismGeigeria plumosa
ReferenceZdero,Phytochem.,28,(1989),3105