input word = C00005869

Metabolite InformationStructural formula
Name Kaempferol 3-(3'',4''-di-p-coumarylrhamnoside)
Formula C39H32O14
Mw 724.17920573
CAS RN 166321-99-9
C_ID C00005869 ,
InChIKey RMHWAEFAOBGGBH-FSQMMUBVNA-N
InChICode InChI=1S/C39H32O14/c1-20-35(51-30(45)16-6-21-2-10-24(40)11-3-21)38(52-31(46)17-7-22-4-12-25(41)13-5-22)34(48)39(49-20)53-37-33(47)32-28(44)18-27(43)19-29(32)50-36(37)23-8-14-26(42)15-9-23/h2-20,34-35,38-44,48H,1H3/b16-6+,17-7+/t20-,34-,35-,38-,39-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)OC(=O)/C=C/c1ccc(cc1)O)OC(=O)/C=C/c1ccc(cc1)O)C)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeLaurus nobilis Ref.
PlantaeLauraceaeOcotea vellosiana Ref.
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OrganismLaurus nobilis
ReferencePower,F.B.et al.,JCS,97,(1910),231-254