input word = C00014512

Metabolite InformationStructural formula
Name Okanin 4-methyl ether 4'-O-(6''-O-p-coumaroylglucoside)
3,4,2',3',4'-Pentahydroxy-4-methoxychalcone 4'-O-(6''-O-p-coumaroylglucoside)
Formula C31H30O13
Mw 610.16864105
CAS RN 142628-32-8
C_ID C00014512 ,
InChIKey JSFGLFKAAYSKDD-SEYGKZQENA-N
InChICode InChI=1S/C31H30O13/c1-41-22-11-5-17(14-21(22)34)4-10-20(33)19-9-12-23(27(37)26(19)36)43-31-30(40)29(39)28(38)24(44-31)15-42-25(35)13-6-16-2-7-18(32)8-3-16/h2-14,24,28-32,34,36-40H,15H2,1H3/b10-4+,13-6+/t24-,28-,29+,30-,31-/m1/s1
SMILES c1(c(c(c(cc1)C(=O)/C=C/c1ccc(c(c1)O)OC)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1ccc(cc1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBidens frondosa Ref.
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