input word = C00063116

Metabolite InformationStructural formula
Name 2-[[3-[2,3-Dihydro-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuranyl]-1-oxo-2-propen-1-yl]oxy]butanedioic acid
Formula C24H24O11
Mw 488.13186161
CAS RN 842162-84-9
C_ID C00063116
InChIKey ACRCZNMXAOIEPP-UHFFFAOYSA-N
InChICode InChI=1S/C24H24O11/c1-32-17-9-13(4-5-16(17)26)22-15(11-25)14-7-12(8-18(33-2)23(14)35-22)3-6-21(29)34-19(24(30)31)10-20(27)28/h3-9,15,19,22,25-26H,10-11H2,1-2H3,(H,27,28)(H,30,31)
SMILES COc1cc(C2Oc3c(OC)cc(C=CC(=O)OC(CC(=O)O)C(=O)O)cc3C2CO)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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