input word = C00010157

Metabolite InformationStructural formula
Name Glycyroside
Formononetin 7-O-apiosyl-(1->2)-glucoside
Formula C27H30O13
Mw 562.16864105
CAS RN 125310-04-5
C_ID C00010157 ,
InChIKey TUUBGLDJKKCMRH-OEVSSYSDNA-N
InChICode InChI=1S/C27H30O13/c1-35-14-4-2-13(3-5-14)17-10-36-18-8-15(6-7-16(18)20(17)30)38-25-23(22(32)21(31)19(9-28)39-25)40-26-24(33)27(34,11-29)12-37-26/h2-8,10,19,21-26,28-29,31-34H,9,11-12H2,1H3/t19-,21-,22-,23+,24-,25+,26-,27-/m0/s1
SMILES COc1ccc(-c2coc3cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O[C@@H]4OC[C@@](O)(CO)C4O)ccc3c2=O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza eurycarpa Ref.
PlantaeFabaceaeGlycyrrhiza glabra Ref.
PlantaeFabaceaeGlycyrrhiza inflata Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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OrganismGlycyrrhiza glabra
ReferenceSong, W. et al., Anal. Chem., 89, (2017), 3146-3153.