input word = C00006332

Metabolite InformationStructural formula
Name Isovitexin 4'-O-glucoside 2''-O-(E)-ferulate
Formula C37H38O18
Mw 770.20581441
CAS RN 64763-02-6
C_ID C00006332 ,
InChIKey RCKBGYPJUBEDCP-PZTYSDKKNA-N
InChICode InChI=1S/C37H38O18/c1-50-22-10-15(2-8-18(22)40)3-9-26(43)55-36-33(48)30(45)24(13-38)53-35(36)28-20(42)12-23-27(31(28)46)19(41)11-21(52-23)16-4-6-17(7-5-16)51-37-34(49)32(47)29(44)25(14-39)54-37/h2-12,24-25,29-30,32-40,42,44-49H,13-14H2,1H3/b9-3+/t24-,25+,29+,30+,32-,33-,34+,35-,36+,37+/m0/s1
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1ccc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)OC(=O)/C=C/c1cc(c(cc1)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaeCerastium arvense Ref.
PlantaeGentianaceaeGentiana punctata Ref.
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OrganismGentiana punctata
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 549,C-glycosylflavones

Luong,Helv.Chim.Acta,60,(1977),2099