input word = C00029867

Metabolite InformationStructural formula
Name Caesaldekarin e
(+)-Caesaldekarin e
Formula C24H30O6
Mw 414.20423869
CAS RN 163662-67-7
C_ID C00029867 ,
InChIKey VVJWDPJDEOTQOZ-SARBHLLPNA-N
InChICode InChI=1S/C24H30O6/c1-13-16-7-9-24(27)22(4,5)20(29-14(2)25)12-21(30-15(3)26)23(24,6)18(16)11-19-17(13)8-10-28-19/h8,10-11,20-21,27H,7,9,12H2,1-6H3/t20-,21+,23+,24-/m1/s1
SMILES CC(=O)O[C@H]1C[C@@H](OC(C)=O)C(C)(C)[C@]2(O)CCc3c(cc4occc4c3C)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia crista Ref.
zoom in