input word = C00055286

Metabolite InformationStructural formula
Name Coronaric acid
Formula C18H32O3
Mw 296.23514489
CAS RN 16833-56-0
C_ID C00055286
InChIKey FBUKMFOXMZRGRB-SQGUUQMOSA-N
InChICode InChI=1S/C18H32O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h7,10,16-17H,2-6,8-9,11-15H2,1H3,(H,19,20)/b10-7-/t16-,17+/m0/s1
SMILES CCCCC/C=CC[C@@H]1O[C@@H]1CCCCCCCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAster alpinus Ref.
PlantaeAsteraceaeChrysanthemum coronarium Ref.
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