input word = C00030769

Metabolite InformationStructural formula
Name Methyl-3-O-feruloylquinate
Formula C18H22O9
Mw 382.1263823
CAS RN 154418-15-2
C_ID C00030769 ,
InChIKey CPYDMLXRLHYXSV-DEHOMXJANA-N
InChICode InChI=1S/C18H22O9/c1-25-13-7-10(3-5-11(13)19)4-6-15(21)27-14-9-18(24,17(23)26-2)8-12(20)16(14)22/h3-7,12,14,16,19-20,22,24H,8-9H2,1-2H3/b6-4+/t12-,14-,16-,18+/m1/s1
SMILES COC(=O)[C@]1(O)C[C@@H](O)[C@@H](O)[C@H](OC(=O)/C=C/c2ccc(O)c(OC)c2)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSantalaceaeViscum coloratum Ref.
zoom in