input word = C00013825

Metabolite InformationStructural formula
Name 6-Hydroxykaempferol 6-methyl ether 3-(6''-p-coumaroylglucoside)
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-6-methoxy-4H-1-benzopyran-4-one
Formula C31H28O14
Mw 624.14790561
CAS RN 235741-38-5
C_ID C00013825 ,
InChIKey QSWRVQDERAITMT-NGQRVIJPNA-N
InChICode InChI=1S/C31H28O14/c1-41-29-18(34)12-19-22(24(29)37)25(38)30(28(43-19)15-5-9-17(33)10-6-15)45-31-27(40)26(39)23(36)20(44-31)13-42-21(35)11-4-14-2-7-16(32)8-3-14/h2-12,20,23,26-27,31-34,36-37,39-40H,13H2,1H3/b11-4+/t20-,23-,26+,27-,31+/m1/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)/C=C/c1ccc(cc1)O)O)O)O)c(c(c(c2)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEriocaulaceaePaepalanthus denudatus Ref.
PlantaeEriocaulaceaePaepalanthus hilairei Ref.
PlantaeEriocaulaceaePaepalanthus polyanthus Ref.
PlantaeEriocaulaceaePaepalanthus ramosus Ref.
PlantaeEriocaulaceaePaepalanthus robustus Ref.
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