input word = C00013778

Metabolite InformationStructural formula
Name Kaempferol 3-(3''-acetyl-6''-p-coumaroylglucoside)
3-[[3-O-Acetyl-6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula C32H28O14
Mw 636.14790561
CAS RN 557765-92-1
C_ID C00013778 ,
InChIKey TUFROJTWZVLLLD-CEXUXPCXNA-N
InChICode InChI=1S/C32H28O14/c1-15(33)43-30-26(39)23(14-42-24(38)11-4-16-2-7-18(34)8-3-16)45-32(28(30)41)46-31-27(40)25-21(37)12-20(36)13-22(25)44-29(31)17-5-9-19(35)10-6-17/h2-13,23,26,28,30,32,34-37,39,41H,14H2,1H3/b11-4+/t23-,26-,28-,30+,32+/m1/s1
SMILES CC(=O)O[C@@H]1C(O)[C@H](Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)OC(COC(=O)/C=C/c2ccc(O)cc2)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAnaphalis aureo-punctata Ref.
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