input word = C00033987

Metabolite InformationStructural formula
Name Ixerisoside L
Formula C36H52O16
Mw 740.32553562
CAS RN 132282-51-0
C_ID C00033987 ,
InChIKey IXOSXWZLCNJRLS-KMJSQKLZNA-N
InChICode InChI=1S/C36H52O16/c1-17(2)25(39)33(46)50-22(14-19-6-8-20(38)9-7-19)32(45)52-24-11-13-36(47,16-49-34-29(43)28(42)27(41)23(15-37)51-34)30-26(40)21(10-12-35(24,30)4)18(3)31(44)48-5/h6-9,17,21-30,34,37-43,47H,3,10-16H2,1-2,4-5H3/t21-,22+,23+,24+,25-,26-,27+,28-,29+,30+,34+,35-,36+/m0/s1
SMILES C=C(C(=O)OC)C1CC[C@@]2(C)[C@H](OC(=O)C(Cc3ccc(O)cc3)OC(=O)C(O)C(C)C)CCC(O)(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]2[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeIxeris repens A.Gray Ref.
zoom in