input word = C00006402

Metabolite InformationStructural formula
Name Vitexin 2''-O-rhamnoside 6''-acetate
Formula C29H32O15
Mw 620.17412036
CAS RN 140242-24-6
C_ID C00006402 ,
InChIKey LYJOXDXHRNOBBV-CEBAZSBTNA-N
InChICode InChI=1S/C29H32O15/c1-10-21(35)23(37)25(39)29(41-10)44-28-24(38)22(36)18(9-40-11(2)30)43-27(28)20-15(33)7-14(32)19-16(34)8-17(42-26(19)20)12-3-5-13(31)6-4-12/h3-8,10,18,21-25,27-29,31-33,35-39H,9H2,1-2H3/t10-,18-,21-,22+,23-,24-,25-,27-,28+,29-/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@@H]2O[C@@H](C)[C@H](O)C(O)C2O)C(O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeClusia sandiensis Ref.
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