input word = C00004431

Metabolite InformationStructural formula
Name 8-Hydroxyluteolin 4'-methyl ether 7-allosyl-(1->2)-glucoside
Formula C28H32O17
Mw 640.1639496
CAS RN 114611-04-0
C_ID C00004431 ,
InChIKey KEDNRSGYJIYJKK-FBUUNXOZNA-N
InChICode InChI=1S/C28H32O17/c1-40-13-3-2-9(4-10(13)31)14-5-11(32)18-12(33)6-15(21(36)25(18)41-14)42-28-26(23(38)20(35)17(8-30)44-28)45-27-24(39)22(37)19(34)16(7-29)43-27/h2-6,16-17,19-20,22-24,26-31,33-39H,7-8H2,1H3/t16-,17+,19+,20+,22-,23-,24-,26+,27-,28+/m0/s1
SMILES c1(cc(c2c(c1O)oc(cc2=O)c1ccc(c(c1)O)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@H]([C@H]([C@H](O)[C@@H](O1)CO)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSideritis incana incana Ref.
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