input word = C00008772

Metabolite InformationStructural formula
Name Dichotosin
Formula C23H28O9
Mw 448.17333249
CAS RN 97399-72-9
C_ID C00008772 ,
InChIKey MPDDNOZYQCUCDA-BUCYQYOJNA-N
InChICode InChI=1S/C23H28O9/c1-28-13-5-3-12(4-6-13)16-8-7-15-17(30-16)9-14(29-2)10-18(15)31-23-22(27)21(26)20(25)19(11-24)32-23/h3-6,9-10,16,19-27H,7-8,11H2,1-2H3/t16-,19+,20+,21-,22-,23+/m0/s1
SMILES COc1ccc([C@@H]2CCc3c(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)cc(OC)cc3O2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGentianaceaeHoppea dichotoma Ref.
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