input word = C00004288

Metabolite InformationStructural formula
Name Luteolin 7-glucuronosyl-(1->2)-glucuronide
Formula C27H26O18
Mw 638.11191403
CAS RN 96400-45-2
C_ID C00004288 ,
InChIKey PBBVWJQPAZYQDB-OYBQOXGENA-N
InChICode InChI=1S/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)/t16-,17-,18-,19-,20+,21-,22-,23+,26-,27+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccc(c(c1)O)O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)O)O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHydrocharitaceaeElodea canadensis Ref.
PlantaeLabiataePerilla frutescens Ref.
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