input word = C00006156

Metabolite InformationStructural formula
Name Apigenin 8-C-(6''-acetylgalactoside)
Formula C23H22O11
Mw 474.11621155
CAS RN 75440-77-6
C_ID C00006156 ,
InChIKey PKDCJXSRTGTJRC-DCHAMPKUNA-N
InChICode InChI=1S/C23H22O11/c1-9(24)32-8-16-19(29)20(30)21(31)23(34-16)18-13(27)6-12(26)17-14(28)7-15(33-22(17)18)10-2-4-11(25)5-3-10/h2-7,16,19-21,23,25-27,29-31H,8H2,1H3/t16-,19-,20+,21-,23-/m0/s1
SMILES CC(=O)OC[C@@H]1O[C@@H](c2c(O)cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc23)C(O)C(O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeBriza media Ref.
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