input word = C00021707

Metabolite InformationStructural formula
Name 4-epi-Isoinuviscolide
Formula C15H20O3
Mw 248.1412445
CAS RN 68832-39-3
C_ID C00021707 ,
InChIKey APMKESKZWHNIDJ-KZDZGRKHNA-N
InChICode InChI=1S/C15H20O3/c1-8-6-13-11(9(2)14(16)18-13)7-12-10(8)4-5-15(12,3)17/h6,10-13,17H,2,4-5,7H2,1,3H3/t10-,11+,12+,13-,15-/m0/s1
SMILES [C@@H]12[C@@H](C[C@H]3[C@H](C=C1C)OC(=O)C3=C)[C@@](CC2)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDittrichia graveolens (L.) GREUTER Ref.
PlantaeAsteraceaeInula helenium Ref.
PlantaeAsteraceaeInula royleana Ref.
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