input word = C00022779

Metabolite InformationStructural formula
Name 1'-O-Bacchabolivyl xylopyranoside
Formula C25H36O7
Mw 448.2461035
CAS RN 120837-99-2
C_ID C00022779 ,
InChIKey AJYCNUBKMVTZPO-AHUCMRRTNA-N
InChICode InChI=1S/C25H36O7/c1-15-5-4-6-19-24(15,2)11-8-17(25(19,3)10-7-16-9-12-30-13-16)22(29)32-23-21(28)20(27)18(26)14-31-23/h5,9,12-13,17-21,23,26-28H,4,6-8,10-11,14H2,1-3H3/t17-,18+,19-,20+,21+,23-,24-,25+/m0/s1
SMILES C1C=C([C@]2([C@H](C1)[C@@]([C@@H](CC2)C(=O)O[C@@H]1OC[C@H]([C@H]([C@H]1O)O)O)(CCc1ccoc1)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis boliviensis Ref.
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