input word = C00063115

Metabolite InformationStructural formula
Name 2-[[3-[4-[2-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-(hydroxymethyl)ethoxy]-3-methoxyphenyl]-1-oxo-2-propen-1-yl]oxy]butanedioic acid
Formula C24H26O12
Mw 506.1424263
CAS RN 842162-82-7
C_ID C00063115
InChIKey FNEZYOAZUSZZKH-UHFFFAOYSA-N
InChICode InChI=1S/C24H26O12/c1-33-17-10-14(5-6-15(17)26)23(30)20(12-25)35-16-7-3-13(9-18(16)34-2)4-8-22(29)36-19(24(31)32)11-21(27)28/h3-10,19-20,23,25-26,30H,11-12H2,1-2H3,(H,27,28)(H,31,32)
SMILES COc1cc(C(O)C(CO)Oc2ccc(C=CC(=O)OC(CC(=O)O)C(=O)O)cc2OC)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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