input word = C00062091

Metabolite InformationStructural formula
Name Urolithin A 3-glucuronide
Formula C19H16O10
Mw 404.07434673
CAS RN 531512-27-3
C_ID C00062091
InChIKey KXBXNRJGUDTJQS-KSPMYQCISA-N
InChICode InChI=1S/C19H16O10/c20-7-1-3-9-10-4-2-8(6-12(10)28-18(26)11(9)5-7)27-19-15(23)13(21)14(22)16(29-19)17(24)25/h1-6,13-16,19-23H,(H,24,25)/t13-,14-,15+,16-,19+/m0/s1
SMILES O=C(O)C1OC(Oc2ccc3c(c2)oc(=O)c2cc(O)ccc23)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLythraceaePunica granatum Ref.
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