input word = C00050969

Metabolite InformationStructural formula
Name Isoobtusitin
Formula C15H16O5
Mw 276.09977362
CAS RN 264879-23-4
C_ID C00050969
InChIKey GMMBRTQVBAGPHK-UHFFFAOYSA-N
InChICode InChI=1S/C15H16O5/c1-9(2)6-7-19-12-8-11-10(4-5-13(16)20-11)14(17)15(12)18-3/h4-6,8,17H,7H2,1-3H3
SMILES COc1c(OCC=C(C)C)cc2oc(=O)ccc2c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePsiadia dentata Ref.
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