input word = C00039894

Metabolite InformationStructural formula
Name Ocimarin
Formula C12H12O4
Mw 220.07355887
CAS RN 10185-02-1
C_ID C00039894 ,
InChIKey VCGFYFKJZGIZMX-UHFFFAOYSA-N
InChICode InChI=1S/C12H12O4/c1-7-9-3-2-8(14)6-11(9)16-12(15)10(7)4-5-13/h2-3,6,13-14H,4-5H2,1H3
SMILES c1(ccc2c(c1)oc(=O)c(c2C)CCO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeOcimum sanctum Ref.
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