input word = C00006125

Metabolite InformationStructural formula
Name Swertisin
6-beta-D-Glucopyranosyl-4',5-dihydroxy-7-methoxyflavone
7-O-Methylapigenin 6-C-beta-D-glucopyranoside
Flavocommelitin
6-beta-D-Glucopyranosyl-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
Formula C22H22O10
Mw 446.12129692
CAS RN 6991-10-2
C_ID C00006125 ,
InChIKey ABRULANJVVJLFI-FPRNEBIWNA-N
InChICode InChI=1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3/t15-,18+,20-,21+,22-/m0/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea spp. Ref.
PlantaeAsteraceaeGaillardia aristata Ref.
PlantaeAsteraceaeGaillardia pulchella Ref.
PlantaeCommelinaceaeCommelina communis L Ref.
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeKnautia montana Ref.
PlantaeDipsacaceae/Diervillaceae/Linnaeaceae/ValerianaceaeScabiosa atropurpurea Ref.
PlantaeEphedraceaeEphedra sinica Ref.
PlantaeGentianaceaeGentiana campestris Ref.
PlantaeGentianaceaeSwertia japonica Ref.
PlantaeGentianaceaeSwertia purpurascens Ref.
PlantaeIridaceaeIris florentina Ref.
PlantaeIridaceaeIris japonica Ref.
PlantaeOxalidaceaeOxalis corniculata Ref.
PlantaeRhamnaceaeZiziphus jujuba Ref.
PlantaeRhamnaceaeZiziphus jujuba var.spinosa Ref.
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OrganismGaillardia aristata
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 549,C-glycosylflavones

Komatsu,Tetrahedron Lett.,(1966),1611

Bouillant,APhytochem.,11,(1972),1858