input word = C00003891

Metabolite InformationStructural formula
Name Desmethoxycentaureidin
5,7,3'-Trihydroxy-6,4'-dimethoxyflavone
Demethoxycentaureidin
5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-6-methoxy-4H-1-benzopyran-4-one
Formula C17H14O7
Mw 330.0739528
CAS RN 22934-99-2
C_ID C00003891 ,
InChIKey VCWFILUULGOFCD-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O7/c1-22-12-4-3-8(5-9(12)18)13-6-10(19)15-14(24-13)7-11(20)17(23-2)16(15)21/h3-7,18,20-21H,1-2H3
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(c(c1)O)OC)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArnica longifolia Ref.
PlantaeAsteraceaeBaccharis gaudichaudiana Ref.
PlantaeAsteraceaeCentaurea nigrescens Ref.
PlantaeAsteraceaeCentaurea phrygia Ref.
PlantaeAsteraceaeHaplopappus scrobiculatus Ref.
PlantaeLabiataeSideritis spp. Ref.
PlantaeLabiataeThymus satureioides Ref.
PlantaeVerbenaceaeDuranta plumieri Ref.
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