input word = C00040512

Metabolite InformationStructural formula
Name Tovophenone C
(-)-Tovophenone C
Formula C29H36O6
Mw 480.25118888
CAS RN 253791-53-6
C_ID C00040512 ,
InChIKey KHCZTQXZRBKGKK-UHFFFAOYNA-N
InChICode InChI=1S/C29H36O6/c1-16(2)11-12-18(17(3)4)14-21-26(32)24(25(31)19-9-8-10-20(30)13-19)28-22(27(21)34-7)15-23(35-28)29(5,6)33/h8-10,13,18,23,30,32-33H,1,3,11-12,14-15H2,2,4-7H3/t18-,23+/m0/s1
SMILES c1(c(c(c2c(c1C(=O)c1cc(ccc1)O)O[C@H](C2)C(C)(O)C)OC)C[C@@H](C(=C)C)CCC(=C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae-GuttiferaeTovomita brevistaminea Ref.
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OrganismTovomita brevistaminea
ReferenceSeo,Phytochem.,52,(1999),669