input word = C00014086

Metabolite InformationStructural formula
Name Vitexin 2''-O-acetyl 4''-O-rhamnoside
Formula C29H32O15
Mw 620.17412036
CAS RN
C_ID C00014086 ,
InChIKey YQZCWVJLTIJRST-HBZNGPHINA-N
InChICode InChI=1S/C29H32O15/c1-10-21(36)22(37)23(38)29(40-10)44-25-18(9-30)43-27(28(24(25)39)41-11(2)31)20-15(34)7-14(33)19-16(35)8-17(42-26(19)20)12-3-5-13(32)6-4-12/h3-8,10,18,21-25,27-30,32-34,36-39H,9H2,1-2H3/t10-,18+,21-,22+,23-,24-,25+,27-,28+,29-/m0/s1
SMILES c1(oc2c(c(=O)c1)c(cc(c2[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)OC(=O)C)O)O)c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeCrataegus monogyna Ref.
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