input word = C00035232

Metabolite InformationStructural formula
Name 6-O-(4-hydroxybenzoyl)-6-epiaucubin
Formula C22H26O11
Mw 466.14751167
CAS RN 83086-32-2
C_ID C00035232 ,
InChIKey JZWZFNOVWZEQMF-FRGGYFOKNA-N
InChICode InChI=1S/C22H26O11/c23-8-11-7-14(31-20(29)10-1-3-12(25)4-2-10)13-5-6-30-21(16(11)13)33-22-19(28)18(27)17(26)15(9-24)32-22/h1-7,13-19,21-28H,8-9H2/t13-,14-,15-,16-,17-,18+,19-,21+,22+/m1/s1
SMILES O=C(O[C@H]1C=C(CO)[C@H]2C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C[C@@H]12)c1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBignoniaceaeTabebuia impetiginosa (MArt.ex.DC) Ref.
zoom in