input word = C00054087

Metabolite InformationStructural formula
Name 7-Acetoxy-6-methoxycoumarin.
Scopoletin acetate
Formula C12H10O5
Mw 234.05282343
CAS RN 56795-51-8
C_ID C00054087
InChIKey HYCLWDHZALFLJV-UHFFFAOYSA-N
InChICode InChI=1S/C12H10O5/c1-7(13)16-11-6-9-8(5-10(11)15-2)3-4-12(14)17-9/h3-6H,1-2H3
SMILES COc1cc2ccc(=O)oc2cc1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia granatensis Ref.
PlantaeMalvaceaeSterculia urens Ref.
PlantaeRutaceaeCitrus limon Ref.
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