input word = C00055365

Metabolite InformationStructural formula
Name Coriandrone E
Formula C13H12O5
Mw 248.06847349
CAS RN 177795-34-5
C_ID C00055365
InChIKey FDLXWTAXBWPMFB-KGFZYKRKSA-N
InChICode InChI=1S/C13H12O5/c1-6-11(14)8-5-9-7(3-4-17-9)12(16-2)10(8)13(15)18-6/h3-6,11,14H,1-2H3/t6-,11-/m0/s1
SMILES COc1c2c(cc3occc13)[C@@H](O)[C@H](C)OC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeCoriandrum sativum Ref.
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