input word = C00063930

Metabolite InformationStructural formula
Name Marminal
Formula C16H16O4
Mw 272.104859
CAS RN 15334-19-7
C_ID C00063930
InChIKey OGCYHMZGMPRXBS-XYOKQWHBSA-N
InChICode InChI=1S/C16H16O4/c1-12(3-2-9-17)8-10-19-14-6-4-13-5-7-16(18)20-15(13)11-14/h4-9,11H,2-3,10H2,1H3/b12-8+
SMILES CC(=CCOc1ccc2ccc(=O)oc2c1)CCC=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeAegle marmelos Ref.
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