input word = C00003306

Metabolite InformationStructural formula
Name Isoalantolactone
Isoallantolactone
Isohelenin
Formula C15H20O2
Mw 232.14632988
CAS RN 470-17-7
C_ID C00003306 ,
InChIKey CVUANYCQTOGILD-GMMMMNJQNA-N
InChICode InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h11-13H,1-2,4-8H2,3H3/t11-,12+,13-,15-/m1/s1
SMILES C1CC(=C)[C@H]2[C@](C1)(C[C@@H]1[C@H](C2)C(=C)C(=O)O1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCarpesium longifolium Ref.
PlantaeAsteraceaeFlourensia riparia Grisebach Ref.
PlantaeAsteraceaeHypochoeris cretensis Ref.
PlantaeAsteraceaeInula grandis Ref.
PlantaeAsteraceaeInula helenium Ref.
PlantaeAsteraceaeInula henium Ref.
PlantaeAsteraceaeInula japonica Ref.
PlantaeAsteraceaeInula racemosa Ref.
PlantaeAsteraceaeInula royleana Ref.
PlantaeAsteraceaeInula salicina Ref.
PlantaeAsteraceaeLiatris cylindrica Ref.
PlantaeAsteraceaeSaussurea lappa Ref.
PlantaeAsteraceaeTelekia speciosa Ref.
PlantaeAsteraceaeXanthium canadense Mill. Ref.
PlantaeScapaniaceaeTritomaria quinquedentata (Huds.) Ref.
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OrganismFlourensia riparia Grisebach
ReferenceUriburu,Phytochem.,65,(2004),2039