input word = C00007892

Metabolite InformationStructural formula
Name Okanin 3'-glucoside
Formula C21H22O11
Mw 450.11621155
CAS RN 115070-76-3
C_ID C00007892 ,
InChIKey GUVPHHLUFIQDHV-BGXQTFDZNA-N
InChICode InChI=1S/C21H22O11/c22-8-15-17(28)18(29)19(30)21(31-15)32-20-13(25)6-3-10(16(20)27)11(23)4-1-9-2-5-12(24)14(26)7-9/h1-7,15,17-19,21-22,24-30H,8H2/b4-1+/t15-,17-,18+,19-,21+/m1/s1
SMILES O=C(/C=C/c1ccc(O)c(O)c1)c1ccc(O)c(O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBidens pilosa Ref.
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