input word = C00054143

Metabolite InformationStructural formula
Name 1-O-Caffeoyl-3-O-feruloylglycerol
Formula C22H22O9
Mw 430.1263823
CAS RN 910101-38-1
C_ID C00054143
InChIKey JKATYZAMIWWOPM-KBXRYBNXSA-N
InChICode InChI=1S/C22H22O9/c1-29-20-11-15(3-7-18(20)25)5-9-22(28)31-13-16(23)12-30-21(27)8-4-14-2-6-17(24)19(26)10-14/h2-11,16,23-26H,12-13H2,1H3/b8-4+,9-5+
SMILES COC1=C(O)C=CC(/C=C/C(OCC(O)COC(/C=C/C2=CC=C(O)C(O)=C2)=O)=O)=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBromeliaceaeAnanas comosus Ref.
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