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=C1CCC2C(OC(=O)C2(C)O)C2C(=C)C(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)CC12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeIxeris repens Ref.
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OrganismIxeris repens
ReferenceWarashina,Phytochem.,29,(1990),3217