input word = C00033980

Metabolite InformationStructural formula
Name Ixerisoside A
Formula C29H34O11
Mw 558.21011193
CAS RN 132341-19-6
C_ID C00033980 ,
InChIKey GJWZSERDLUJEOD-GFSXNMAYNA-N
InChICode InChI=1S/C29H34O11/c1-12-8-19(37-21(32)9-15-4-6-16(31)7-5-15)23-14(3)28(36)40-27(23)22-13(2)18(10-17(12)22)38-29-26(35)25(34)24(33)20(11-30)39-29/h4-7,17-20,22-27,29-31,33-35H,1-3,8-11H2/t17-,18+,19-,20+,22-,23+,24+,25-,26+,27+,29+/m1/s1
SMILES C=C1CC(OC(=O)Cc2ccc(O)cc2)[C@@H]2C(=C)C(=O)O[C@H]2[C@@H]2C(=C)C(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)CC12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCrepis tingitana Ball Ref.
PlantaeAsteraceaeIxeris chinensis Nakai Ref.
PlantaeAsteraceaeIxeris debilis A. Gray Ref.
PlantaeAsteraceaeScorzoneroides muelleri (Sch.Bip.) Ref.
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