input word = C00033897

Metabolite InformationStructural formula
Name Guaiacylglycerol-beta-ferulic acid ether
Formula C20H22O8
Mw 390.13146768
CAS RN 639017-74-6
C_ID C00033897 ,
InChIKey VRPSNHRJPVYMJT-XBXARRHUNA-N
InChICode InChI=1S/C20H22O8/c1-26-16-10-13(5-6-14(16)22)20(25)18(11-21)28-15-7-3-12(4-8-19(23)24)9-17(15)27-2/h3-10,18,20-22,25H,11H2,1-2H3,(H,23,24)/b8-4+/t18-,20+/m0/s1
SMILES c1(ccc(cc1OC)[C@H]([C@@H](Oc1c(cc(cc1)/C=C/C(=O)O)OC)CO)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGesneriaceaeAeschynanthus bracteatus Ref.
PlantaeSolanaceaeSolanum nigrum Ref.
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