input word = C00004464

Metabolite InformationStructural formula
Name Tricin 7-O-glucuronide
Formula C23H22O13
Mw 506.10604079
CAS RN 32769-02-1
C_ID C00004464 ,
InChIKey HJWFFBNADKDQPV-CJKJZXGWNA-N
InChICode InChI=1S/C23H22O13/c1-32-14-3-8(4-15(33-2)17(14)26)12-7-11(25)16-10(24)5-9(6-13(16)35-12)34-23-20(29)18(27)19(28)21(36-23)22(30)31/h3-7,18-21,23-24,26-29H,1-2H3,(H,30,31)/t18-,19-,20+,21-,23+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(c(c1)OC)O)OC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMedicago sativa Ref.
PlantaeOrobanchaceaePedicularis longiflora var. tubiformis Ref.
PlantaePoaceaeStipa lemmonii Ref.
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