input word = C00044091

Metabolite InformationStructural formula
Name Annuionone C
(-)-Annuionone C
Formula C13H20O3
Mw 224.1412445
CAS RN 211183-74-3
C_ID C00044091 ,
InChIKey DZVNWYFIADDOQC-ZWGCBSEDNA-N
InChICode InChI=1S/C13H20O3/c1-9(14)5-6-13-11(2,3)7-10(15)8-12(13,4)16-13/h5-6,9,14H,7-8H2,1-4H3/b6-5+/t9-,12+,13-/m1/s1
SMILES [C@@]12([C@@](CC(=O)CC1(C)C)(C)O2)/C=C/[C@H](O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annus Ref.
PlantaeAsteraceaeHelianthus annuus Ref.
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OrganismHelianthus annuus
ReferenceMiyase, T. et al., Chem. Pharm. Bull., 1987, 35, 1109-1117 (Icariside B2)