input word = C00021048

Metabolite InformationStructural formula
Name Microhelenin E
Formula C14H16O4
Mw 248.104859
CAS RN 82611-89-0
C_ID C00021048 ,
InChIKey JJOYJHKNKRXXFW-HUYVKLKONA-N
InChICode InChI=1S/C14H16O4/c1-7-5-12-9(8(2)13(16)18-12)6-10-11(15)3-4-14(7,10)17/h3-4,7,9-10,12,17H,2,5-6H2,1H3/t7-,9-,10+,12-,14+/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@H](C)[C@]3(O)C=CC(=O)[C@@H]3C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelenium microcephalum Ref.
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