input word = C00059941

Metabolite InformationStructural formula
Name 3-[4-(beta-D-Glucopyranosyloxy)-3-methoxyphenyl]-2-propenoic acid
Formula C16H20O9
Mw 356.11073224
CAS RN 14364-12-6
C_ID C00059941
InChIKey IEMIRSXOYFWPFD-BJGSYIFTSA-N
InChICode InChI=1S/C16H20O9/c1-23-10-6-8(3-5-12(18)19)2-4-9(10)24-16-15(22)14(21)13(20)11(7-17)25-16/h2-6,11,13-17,20-22H,7H2,1H3,(H,18,19)/b5-3+/t11-,13-,14+,15-,16-/m1/s1
SMILES COc1cc(C=CC(=O)O)ccc1OC1OC(CO)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMatricaria recutita Ref.
PlantaePinaceaePicea abies Ref.
PlantaeSolanaceaeNicotiana tabacum Ref.
PlantaeSolanaceaeSolanum lycopersicum Ref.
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