input word = C00004426

Metabolite InformationStructural formula
Name 8-Hydroxyluteolin 7-[6'''-acethylallosyl-(1->2)-3''-acetylglucoside]
Formula C31H34O19
Mw 710.16942891
CAS RN 135626-71-0
C_ID C00004426 ,
InChIKey AWJLZPJIKGCJCY-UYOKJVKMNA-N
InChICode InChI=1S/C31H34O19/c1-10(33)44-9-20-22(39)25(42)26(43)30(49-20)50-29-28(45-11(2)34)24(41)19(8-32)48-31(29)47-18-7-16(38)21-15(37)6-17(46-27(21)23(18)40)12-3-4-13(35)14(36)5-12/h3-7,19-20,22,24-26,28-32,35-36,38-43H,8-9H2,1-2H3/t19-,20-,22-,24-,25+,26+,28+,29-,30+,31-/m1/s1
SMILES c1(cc(c2c(c1O)oc(cc2=O)c1ccc(c(c1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)OC(=O)C)O[C@H]1[C@H]([C@H]([C@H](O)[C@H](O1)COC(=O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeStachys aegyptiaca Ref.
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