input word = C00047657

Metabolite InformationStructural formula
Name 2-Hydroxyfissinolide
Formula C29H36O9
Mw 528.23593275
CAS RN 29243-94-5
C_ID C00047657 ,
InChIKey XVICTUZGWSSFJE-YNUMXIJNNA-N
InChICode InChI=1S/C29H36O9/c1-15(30)37-25-26(2,3)20(12-21(31)35-6)28(5)18-7-9-27(4)19(17(18)13-29(25,34)24(28)33)11-22(32)38-23(27)16-8-10-36-14-16/h8,10,14,18,20,23,25,34H,7,9,11-13H2,1-6H3/t18-,20-,23-,25-,27+,28+,29-/m0/s1
SMILES [C@@H]1(C([C@@H]([C@]2([C@@H]3C(=C4[C@@](CC3)([C@@H](OC(=O)C4)c3ccoc3)C)C[C@]1(O)C2=O)C)CC(=O)OC)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeSwietenia mahagoni Ref.
zoom in