input word = C00050867

Metabolite InformationStructural formula
Name Isoarcapillin
Formula C18H16O8
Mw 360.08451749
CAS RN 85819-50-7
C_ID C00050867
InChIKey HPDHWLHTEDKQKQ-UHFFFAOYSA-N
InChICode InChI=1S/C18H16O8/c1-23-11-5-9(19)13(24-2)4-8(11)12-6-10(20)16-14(26-12)7-15(25-3)17(21)18(16)22/h4-7,19,21-22H,1-3H3
SMILES COc1cc(-c2cc(=O)c3c(O)c(O)c(OC)cc3o2)c(OC)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia capillaris Ref.
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