input word = C00029434

Metabolite InformationStructural formula
Name 2,4-Dihydroxy-6-phenethyl-benzoic acid methyl ester
Formula C16H16O4
Mw 272.104859
CAS RN 16929-92-3
C_ID C00029434 ,
InChIKey ROMUMXDSMIIOLM-UHFFFAOYSA-N
InChICode InChI=1S/C16H16O4/c1-20-16(19)15-12(9-13(17)10-14(15)18)8-7-11-5-3-2-4-6-11/h2-6,9-10,17-18H,7-8H2,1H3
SMILES COC(=O)c1c(O)cc(O)cc1CCc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeBoesenbergia rotunda (LINN.) MANSF. Ref.
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