input word = C00040957

Metabolite InformationStructural formula
Name Fissinolide
Formula C29H36O8
Mw 512.24101813
CAS RN 1915-69-1
C_ID C00040957 ,
InChIKey YOTCKRFNSMJTGD-JWSQWEHVNA-N
InChICode InChI=1S/C29H36O8/c1-15(30)36-26-18-11-17-19(29(5,24(18)33)21(27(26,2)3)13-22(31)34-6)7-9-28(4)20(17)12-23(32)37-25(28)16-8-10-35-14-16/h8,10,14,18-19,21,25-26H,7,9,11-13H2,1-6H3/t18-,19+,21+,25+,26-,28-,29-/m1/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@@H]1C2=O)C)CC(=O)OC)(C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCedrela fissilis Ref.
PlantaeMeliaceaeGuarea trichilioides Ref.
PlantaeMeliaceaeKhaya grandifoliola Ref.
PlantaeMeliaceaeKhaya madagascariensis Ref.
PlantaeMeliaceaeKhaya senegalensis Ref.
PlantaeMeliaceaeSwietenia mahagoni Ref.
PlantaeMeliaceaeXylocarpus granatum Ref.
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OrganismKhaya senegalensis
ReferenceKhalid,Phytochem.,49,(1998),1769