input word = C00013666

Metabolite InformationStructural formula
Name Luteolin 7-(6''-p-benzoyglucoside)
Formula C28H24O12
Mw 552.12677623
CAS RN
C_ID C00013666 ,
InChIKey WQJPXRDOEHYGGB-LALOAMSONA-N
InChICode InChI=1S/C28H24O12/c29-16-7-6-14(8-17(16)30)20-11-19(32)23-18(31)9-15(10-21(23)39-20)38-28-26(35)25(34)24(33)22(40-28)12-37-27(36)13-4-2-1-3-5-13/h1-11,22,24-26,28-31,33-35H,12H2/t22-,24-,25+,26-,28-/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(cc1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)c1ccccc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeVitex agnus-castus Ref.
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OrganismVitex agnus-castus
ReferenceHirobe,Phytochem.,46,(1997),521