input word = C00035821

Metabolite InformationStructural formula
Name Cedkathryn B
(+)-Cedkathryn B
Formula C25H28O7
Mw 440.18350325
CAS RN 810667-74-4
C_ID C00035821 ,
InChIKey ZLKNSNBMQLJCPU-AAEXIBGKNA-N
InChICode InChI=1S/C25H28O7/c1-21(2)17(22(3)7-5-18(26)31-22)11-24(32-21)10-15-16(30-24)4-8-23-13-25(15,23)20(27)29-19(23)14-6-9-28-12-14/h5-7,9,12,15-17,19H,4,8,10-11,13H2,1-3H3/t15-,16-,17+,19+,22+,23-,24-,25-/m1/s1
SMILES CC1(C)O[C@]2(C[C@@H]3[C@@H](CC[C@]45C[C@]34C(=O)O[C@H]5c3ccoc3)O2)C[C@@H]1[C@@]1(C)C=CC(=O)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCedrelopsis gracilis Ref.
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OrganismCedrelopsis gracilis
ReferenceMulholland,Phytochem.,65,(2004),2929