input word = C00007185

Metabolite InformationStructural formula
Name Neoisoliquiritigenin
Neoisoliquiritin
Formula C21H22O9
Mw 418.1263823
CAS RN 59122-93-9
C_ID C00007185 ,
InChIKey XQWFHGOIUZFQPJ-RCWMLILLNA-N
InChICode InChI=1S/C21H22O9/c22-10-17-18(26)19(27)20(28)21(30-17)29-13-6-7-14(16(25)9-13)15(24)8-3-11-1-4-12(23)5-2-11/h1-9,17-23,25-28H,10H2/b8-3+/t17-,18+,19-,20+,21+/m0/s1
SMILES c1(cc(c(cc1)C(=O)/C=C/c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDahlia variabilis Ref.
PlantaeAsteraceaeViguiera spp. Ref.
PlantaeFabaceaeCicer arietinum Ref.
PlantaeFabaceaeGlycine max Ref.
PlantaeFabaceaeGlycyrrhiza glabra Ref.
PlantaeFabaceaeGlycyrrhiza inflata Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
PlantaeFabaceaeSpatholobus suberectus Dunn Ref.
PlantaeFabaceaeUlex europaeus Ref.
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