input word = C00005549

Metabolite InformationStructural formula
Name Isorhamnetin 3-alpha-L-arabinopyranosyl-(1->2)-rhamnoside
Formula C27H30O15
Mw 594.15847029
CAS RN 29556-94-3
C_ID C00005549 ,
InChIKey KEVHBKCMNNPOKL-SYYNZFPJNA-N
InChICode InChI=1S/C27H30O15/c1-9-18(32)21(35)25(42-26-22(36)19(33)14(31)8-38-26)27(39-9)41-24-20(34)17-13(30)6-11(28)7-16(17)40-23(24)10-3-4-12(29)15(5-10)37-2/h3-7,9,14,18-19,21-22,25-33,35-36H,8H2,1-2H3/t9-,14-,18-,19-,21+,22+,25-,26-,27-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)O)O)O)C)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBrassicaceaeCheiranthus allionii Ref.
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