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 O=C(O)[C@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3)O[C@H](C(=O)O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHydrocharitaceaeElodea canadensis Ref.
PlantaeLabiataePerilla frutescens Ref.
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