input word = C00050323

Metabolite InformationStructural formula
Name 7-Deoxy-7-oxodunnianin
(-)-7-Deoxy-7-oxodunnianin
Formula C22H26O7
Mw 402.16785319
CAS RN 178664-71-6
C_ID C00050323 ,
InChIKey PDRWNRBNRBWFCQ-IBILKBQRNA-N
InChICode InChI=1S/C22H26O7/c1-13-9-16-22(27)19(2,12-28-18(25)14-7-5-4-6-8-14)20(3,26)15(23)10-21(13,22)11-17(24)29-16/h4-8,13,16,26-27H,9-12H2,1-3H3/t13-,16+,19-,20+,21-,22+/m1/s1
SMILES [C@@]1(C(=O)C[C@@]23[C@@]([C@@]1(COC(=O)c1ccccc1)C)([C@@H](OC(=O)C2)C[C@H]3C)O)(C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIlliciaceaeIllicium floridanum Ref.
zoom in