input word = C00014090

Metabolite InformationStructural formula
Name Vitexin 6''-O-acetate
Psilosin
Formula C23H22O11
Mw 474.11621155
CAS RN 156790-77-1
C_ID C00014090 ,
InChIKey PKDCJXSRTGTJRC-TYMQJJOKNA-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+/m1/s1
SMILES c1(oc2c(c(=O)c1)c(cc(c2[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)O)O)c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeCrataegus pinnatifida Ref.
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