input word = C00012947

Metabolite InformationStructural formula
Name (+)-Graveolide
Graveolide
2,3-Dihydroaromaticin
[3aR-(3aalpha,4abeta,7aalpha,8alpha,9abeta)]-Decahydro-4a,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2,5-dione
Formula C15H20O3
Mw 248.1412445
CAS RN 72173-44-5
C_ID C00012947 ,
InChIKey DCKYPAZZUYXYTC-JGFHCSSGNA-N
InChICode InChI=1S/C15H20O3/c1-8-6-12-10(9(2)14(17)18-12)7-15(3)11(8)4-5-13(15)16/h8,10-12H,2,4-7H2,1,3H3/t8-,10-,11+,12+,15+/m1/s1
SMILES [C@@H]12[C@H](C[C@H]([C@H]3[C@](C1)(C(=O)CC3)C)C)OC(=O)C2=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDittrichia graveolens (L.) GREUTER Ref.
PlantaeAsteraceaeInula graveolens Ref.
PlantaeAsteraceaeTelekia speciosa Ref.
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OrganismInula graveolens
Referenced'Alcontres,Gazz.Chim.Ital.,103,(1973),239