input word = C00007900

Metabolite InformationStructural formula
Name Okanin 4'-(3'',4''-diacetyl-6''-p-coumarylglucoside)
Formula C34H32O15
Mw 680.17412036
CAS RN 118853-81-9
C_ID C00007900 ,
InChIKey UJYBDMFSYTYAFJ-XZNYVACNNA-N
InChICode InChI=1S/C34H32O15/c1-17(35)46-32-27(16-45-28(41)14-7-19-3-8-21(37)9-4-19)49-34(31(44)33(32)47-18(2)36)48-26-13-10-22(29(42)30(26)43)23(38)11-5-20-6-12-24(39)25(40)15-20/h3-15,27,31-34,37,39-40,42-44H,16H2,1-2H3/b11-5+,14-7+/t27-,31-,32-,33-,34-/m1/s1
SMILES CC(=O)O[C@@H]1C(COC(=O)/C=C/c2ccc(O)cc2)O[C@@H](Oc2ccc(C(=O)/C=C/c3ccc(O)c(O)c3)c(O)c2O)C(O)[C@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBidens pilosa Ref.
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OrganismBidens pilosa
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 115,Chalcones,dihydrochalcones and aurones

Hoffmann,Planta Med.,54,(1988),450