input word = C00004639

Metabolite InformationStructural formula
Name 3,3'-Dimethylquercetin
Quercetin 3,3'-dimethyl ether
5,7,4'-Trihydroxy-3,3'-dimethoxyflavone
5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-methoxy-4H-1-benzopyran-4-one
Formula C17H14O7
Mw 330.0739528
CAS RN 4382-17-6
C_ID C00004639 ,
InChIKey FMEHGPQTMOPUGM-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O7/c1-22-12-5-8(3-4-10(12)19)16-17(23-2)15(21)14-11(20)6-9(18)7-13(14)24-16/h3-7,18-20H,1-2H3
SMILES c1(cc(c2c(c1)oc(c(c2=O)OC)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnarthriaceaeAnarthria scabra Ref.
PlantaeAsteraceaeAjania fruticulosa Ref.
PlantaeAsteraceaeCentipeda minima Ref.
PlantaeAsteraceaeChrysothamnus humilis Ref.
PlantaeAsteraceaeChrysothamnus viscidiflorus Ref.
PlantaeAsteraceaePluchea sericea Ref.
PlantaeAsteraceaeRhaponticum carthamoides Ref.
PlantaeBoraginaceaeHeliotropium sinuatum Ref.
PlantaeBoraginaceaeHeliotropium stenophyllum Ref.
PlantaeCalceolariaceaeCalceolaria spp. Ref.
PlantaeCapparaceaeCleome amplyocarpa Ref.
PlantaeCunoniaceaeEucryphia lucida Ref.
PlantaeCyperaceaeCyperus alopecuroides Ref.
PlantaeFabaceaeAcacia neovernicosa Ref.
PlantaeFabaceaeAstragalus alopecurus Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
PlantaeFabaceaeProsopis fiebrigii Ref.
PlantaeFabaceaeProsopis hassleri Ref.
PlantaeFouquieriaceaFouquieria splendens Ref.
PlantaeLabiataeSalvia pedicellata Ref.
PlantaeNothofagaceae/FagaceaeNothofagus menziesii Ref.
PlantaeNothofagaceae/FagaceaeNothofagus nervosa Ref.
PlantaeNyctaginaceaeMirabilis viscosa Ref.
PlantaePhrymaceaeMimulus lewisii Ref.
PlantaeRosaceaeCotoneaster microphylla Ref.
PlantaeRosaceaeRubus phoenicolasius Ref.
PlantaeRutaceaeBarosma crenulata Ref.
PlantaeRutaceaeMelicope coodeana Ref.
PlantaeSantalaceaeViscum album Ref.
PlantaeSantalaceaeViscum cruciatum Ref.
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OrganismCyperus alopecuroides
ReferenceNassar,Phytochem.,60,(2002),385