input word = C00004112

Metabolite InformationStructural formula
Name Chrysin 7-glucuronide
Chrysin-7-glucuronide
Formula C21H18O10
Mw 430.0899968
CAS RN 35775-49-6
C_ID C00004112 ,
InChIKey IDRSJGHHZXBATQ-GGNWGOABNA-N
InChICode InChI=1S/C21H18O10/c22-11-6-10(29-21-18(26)16(24)17(25)19(31-21)20(27)28)7-14-15(11)12(23)8-13(30-14)9-4-2-1-3-5-9/h1-8,16-19,21-22,24-26H,(H,27,28)/t16-,17-,18+,19+,21+/m0/s1
SMILES O=C(O)C1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccccc4)oc3c2)C(O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeScutellaria baicalensis Ref.
PlantaeLabiataeScutellaria galericulata Ref.
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