input word = C00006369

Metabolite InformationStructural formula
Name Vitexin 2''-acetate
Formula C23H22O11
Mw 474.11621155
CAS RN 264142-91-8
C_ID C00006369 ,
InChIKey VTAJPRWLLGFCBK-DFJRKEPHNA-N
InChICode InChI=1S/C23H22O11/c1-9(25)32-23-20(31)19(30)16(8-24)34-22(23)18-13(28)6-12(27)17-14(29)7-15(33-21(17)18)10-2-4-11(26)5-3-10/h2-7,16,19-20,22-24,26-28,30-31H,8H2,1H3/t16-,19-,20+,22+,23-/m1/s1
SMILES CC(=O)OC1[C@@H](O)[C@H](O)C(CO)O[C@H]1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeCrataegus pinnatifida Ref.
PlantaeRosaceaeCrataegus sanguinea Ref.
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