input word = C00036083

Metabolite InformationStructural formula
Name Cedmiline
Formula C24H28O6
Mw 412.18858863
CAS RN 249286-43-9
C_ID C00036083 ,
InChIKey JFVLLZQSYBQDMP-UHFFFAOYNA-N
InChICode InChI=1S/C24H28O6/c1-21(2)17-11-15(25)12-24-16(22(17,3)9-6-18(26)29-21)5-8-23(4,20(24)27)19(30-24)14-7-10-28-13-14/h6-7,9-10,13,16-17,19H,5,8,11-12H2,1-4H3/t16-,17+,19+,22-,23+,24+/m1/s1
SMILES [C@@H]12[C@@]3([C@@H](CC(=O)C[C@@]41O[C@H]([C@@](CC2)(C)C4=O)c1ccoc1)C(OC(=O)C=C3)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeCedrelopsis grevei Ref.
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OrganismCedrelopsis grevei
ReferenceMulholland,Phytochem.,64,(2003),631