input word = C00036616

Metabolite InformationStructural formula
Name 6-Epiaucubin
Formula C15H22O9
Mw 346.1263823
CAS RN 82535-77-1
C_ID C00036616 ,
InChIKey RJWJHRPNHPHBRN-JWRRYOTANA-N
InChICode InChI=1S/C15H22O9/c16-4-6-3-8(18)7-1-2-22-14(10(6)7)24-15-13(21)12(20)11(19)9(5-17)23-15/h1-3,7-21H,4-5H2/t7-,8-,9-,10-,11+,12+,13-,14+,15+/m1/s1
SMILES O1C=C[C@H]2[C@H]([C@@H]1O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)C(=C[C@H]2O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlantaginaceaePlantago subulata Ref.
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