input word = C00005843

Metabolite InformationStructural formula
Name 6''-O-Acetylastragalin
Kaempferol 3-(6''-acetylglucoside)
Formula C23H22O12
Mw 490.11112617
CAS RN 118169-27-0
C_ID C00005843 ,
InChIKey AKENCGNASJPQNR-BBUAEBONNA-N
InChICode InChI=1S/C23H22O12/c1-9(24)32-8-15-17(28)19(30)20(31)23(34-15)35-22-18(29)16-13(27)6-12(26)7-14(16)33-21(22)10-2-4-11(25)5-3-10/h2-7,15,17,19-20,23,25-28,30-31H,8H2,1H3/t15-,17-,19+,20-,23+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArnica chamissonis Ref.
PlantaeAsteraceaeSolidago spp. Ref.
PlantaeMoraceaeMorus alba Ref.
PlantaePinaceaePicea abies Ref.
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