input word = C00012187

Metabolite InformationStructural formula
Name (-)-Heliangolide
Heliangolide
Formula C15H20O3
Mw 248.1412445
CAS RN 65556-51-6
C_ID C00012187 ,
InChIKey XQVSREKNQZKAKU-UKYNBTGXNA-N
InChICode InChI=1S/C15H20O3/c1-9-4-6-12-11(3)15(17)18-14(12)8-10(2)13(16)7-5-9/h5,8,12-14,16H,3-4,6-7H2,1-2H3/b9-5+,10-8-/t12-,13-,14-/m0/s1
SMILES [C@@H]12[C@@H](OC(=O)C1=C)/C=C(\[C@H](C/C=C(/CC2)\C)O)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum tanacetiodes Ref.
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