input word = C00004176

Metabolite InformationStructural formula
Name Apigenin 7-(2''-acetylglucoside)
Formula C23H22O11
Mw 474.11621155
CAS RN 75357-75-4
C_ID C00004176 ,
InChIKey LGPATLKJAZAUNQ-JOGGKIJDNA-N
InChICode InChI=1S/C23H22O11/c1-10(25)31-22-21(30)20(29)18(9-24)34-23(22)32-13-6-14(27)19-15(28)8-16(33-17(19)7-13)11-2-4-12(26)5-3-11/h2-8,18,20-24,26-27,29-30H,9H2,1H3/t18-,20+,21-,22+,23+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMatricaria chamomilla Ref.
PlantaeAsteraceaeMatricaria recutita Ref.
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