input word = C00033965

Metabolite InformationStructural formula
Name Ixerin I
Formula C29H36O11
Mw 560.22576199
CAS RN 94356-10-2
C_ID C00033965 ,
InChIKey PWQMKQMDXFLIOW-VIJQRXGINA-N
InChICode InChI=1S/C29H36O11/c1-16-21-10-7-18(14-37-24(32)12-17-5-8-20(31)9-6-17)3-2-4-19(11-22(21)39-28(16)36)15-38-29-27(35)26(34)25(33)23(13-30)40-29/h3,5-6,8-9,11,21-23,25-27,29-31,33-35H,1-2,4,7,10,12-15H2/b18-3+,19-11+/t21-,22-,23-,25-,26+,27-,29+/m1/s1
SMILES C=C1C(=O)OC2/C=C(CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC/C=C(/COC(=O)Cc3ccc(O)cc3)CCC12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeIxeris tamagawaensis Kitam. Ref.
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OrganismIxeris tamagawaensis Kitam.
ReferenceZidorn,Phytochem.,69,(2008),2270