input word = C00020470

Metabolite InformationStructural formula
Name Ixerisoside C
Formula C21H30O9
Mw 426.18898256
CAS RN 132282-41-8
C_ID C00020470 ,
InChIKey JUWLBYAQEMASID-RBGVGVPXNA-N
InChICode InChI=1S/C21H30O9/c1-8-4-5-11-18(30-20(26)21(11,3)27)14-9(2)12(6-10(8)14)28-19-17(25)16(24)15(23)13(7-22)29-19/h10-19,22-25,27H,1-2,4-7H2,3H3/t10-,11+,12-,13-,14-,15-,16+,17-,18-,19-,21-/m1/s1
SMILES [C@@H]1(C(=C)[C@@H]2[C@H](C1)C(=C)CC[C@H]1[C@H]2OC(=O)[C@]1(C)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeIxeris repens Ref.
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