input word = C00009922

Metabolite InformationStructural formula
Name Isoangustone A
5,7,3',4'-Tetrahydroxy-6,5'-diprenylisoflavone
Formula C25H26O6
Mw 422.17293856
CAS RN 129280-34-8
C_ID C00009922 ,
InChIKey QNLGNISMYMFVHP-UHFFFAOYSA-N
InChICode InChI=1S/C25H26O6/c1-13(2)5-7-15-9-16(10-20(27)23(15)28)18-12-31-21-11-19(26)17(8-6-14(3)4)24(29)22(21)25(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3
SMILES c1(c(c(c2c(c1)occ(c2=O)c1cc(c(c(c1)CC=C(C)C)O)O)O)CC=C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza glabra Ref.
PlantaeFabaceaeGlycyrrhiza inflata Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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OrganismGlycyrrhiza inflata
ReferenceSong, W. et al., Anal. Chem., 89, (2017), 3146-3153.