input word = C00019078

Metabolite InformationStructural formula
Name Scandenal
3'-Formyl-4',5-dihydroxy-2'',2''-dimethylchromeno[6,7:5'',6'']isoflavone
Formula C21H16O6
Mw 364.09468824
CAS RN 478409-38-0
C_ID C00019078 ,
InChIKey IPYCUHYELBKADC-UHFFFAOYSA-N
InChICode InChI=1S/C21H16O6/c1-21(2)6-5-13-16(27-21)8-17-18(19(13)24)20(25)14(10-26-17)11-3-4-15(23)12(7-11)9-22/h3-10,23-24H,1-2H3
SMILES C1(C=Cc2c(O1)cc1c(c2O)c(=O)c(co1)c1ccc(c(c1)C=O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDerris scandens Ref.
PlantaeFabaceaeDerris scandens Benth. Ref.
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