input word = C00005273

Metabolite InformationStructural formula
Name Rhamnocitrin 3-glucuronide
Formula C22H20O12
Mw 476.09547611
CAS RN 52936-61-5
C_ID C00005273 ,
InChIKey QZBZMHBKELXHBZ-GAOPBNHONA-N
InChICode InChI=1S/C22H20O12/c1-31-10-6-11(24)13-12(7-10)32-18(8-2-4-9(23)5-3-8)19(14(13)25)33-22-17(28)15(26)16(27)20(34-22)21(29)30/h2-7,15-17,20,22-24,26-28H,1H3,(H,29,30)/t15-,16-,17+,20-,22+/m0/s1
SMILES COc1cc(O)c2c(=O)c(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)C(O)C3O)c(-c3ccc(O)cc3)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeVerbesina myriocephala Ref.
PlantaeDilleniaceaeTetracera rosiflora Ref.
PlantaeDilleniaceaeTetracera rutenbergii Ref.
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