Name |
Quercetin 3-[(6''-feruloylglucosyl)-(1->2)-beta-arabinopyranoside]-7-glucoside 2-(3,4-Dihydroxyphenyl)-7-(beta-D-glucopyranosyloxy)-5-hydroxy-3-[[2-O-[6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]-beta-L-arabinopyranosyl]oxy]-4H-1-benzopyran-4-one |
Formula |
C42H46O24 |
Mw |
934.2379024 |
CAS RN |
274931-29-2 |
C_ID |
C00013890
,
|
InChIKey |
FRAGXEORXUIKAD-IMVBRQKDNA-N |
InChICode |
InChI=1S/C42H46O24/c1-58-23-8-15(2-5-19(23)45)3-7-27(49)59-14-26-31(52)34(55)36(57)41(64-26)66-39-29(50)22(48)13-60-42(39)65-38-32(53)28-21(47)10-17(61-40-35(56)33(54)30(51)25(12-43)63-40)11-24(28)62-37(38)16-4-6-18(44)20(46)9-16/h2-11,22,25-26,29-31,33-36,39-48,50-52,54-57H,12-14H2,1H3/b7-3+/t22-,25-,26+,29-,30+,31+,33-,34-,35+,36+,39-,40+,41-,42+/m0/s1 |
SMILES |
c1c(cc(c(c1)O)O)c1oc2c(c(=O)c1O[C@@H]1[C@H]([C@H]([C@H](CO1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1cc(c(cc1)O)OC)O)O)O)c(cc(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Cruciferae | Carrichtera annua | Ref. |
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