input word = C00006004

Metabolite InformationStructural formula
Name Isorhamnetin 3-(2''-acetylglucoside)
Formula C24H24O13
Mw 520.12169086
CAS RN 119628-57-8
C_ID C00006004 ,
InChIKey ORAIMDQSZIUQPL-KBYKHOOUNA-N
InChICode InChI=1S/C24H24O13/c1-9(26)34-23-20(32)18(30)16(8-25)36-24(23)37-22-19(31)17-13(29)6-11(27)7-15(17)35-21(22)10-3-4-12(28)14(5-10)33-2/h3-7,16,18,20,23-25,27-30,32H,8H2,1-2H3/t16-,18+,20-,23+,24-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)OC(=O)C)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSedum acre Ref.
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