input word = C00006088

Metabolite InformationStructural formula
Name Isovitexin 7-O-sulfate
Formula C21H20O13S
Mw 512.06246146
CAS RN
C_ID C00006088 ,
InChIKey UAKAGPYTKCXGGC-XZIDVWOUNA-N
InChICode InChI=1S/C21H20O13S/c22-7-14-17(25)19(27)20(28)21(33-14)16-13(34-35(29,30)31)6-12-15(18(16)26)10(24)5-11(32-12)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-28H,7H2,(H,29,30,31)/t14-,17+,19-,20+,21-/m0/s1
SMILES O=c1cc(-c2ccc(O)cc2)oc2cc(OS(=O)(=O)O)c([C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)c(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePalmaePhoenix roebelenii Ref.
PlantaePalmaePhoenix tomentosa Ref.
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