input word = C00029953

Metabolite InformationStructural formula
Name Cichorioside G
(-)-Cichorioside G
Formula C21H28O10
Mw 440.16824712
CAS RN 1086489-75-9
C_ID C00029953 ,
InChIKey NUAIXFCSBZGUAF-KLPLUNHYNA-N
InChICode InChI=1S/C21H28O10/c1-7-3-11(29-21-18(27)17(26)16(25)12(6-23)30-21)14-8(2)20(28)31-19(14)15-9(5-22)4-10(24)13(7)15/h4,8,11-12,14-19,21-23,25-27H,3,5-6H2,1-2H3/t8-,11-,12+,14+,15-,16+,17-,18+,19-,21+/m0/s1
SMILES [C@H]12C(=C(C[C@@H]([C@@H]3[C@@H]1OC(=O)[C@H]3C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)C(=O)C=C2CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCichorium endivia Ref.
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