input word = C00036082

Metabolite InformationStructural formula
Name Cedashnine
Formula C24H28O8
Mw 444.17841787
CAS RN 627082-62-6
C_ID C00036082 ,
InChIKey MSSXDTAEWFZRTE-UHFFFAOYNA-N
InChICode InChI=1S/C24H28O8/c1-21(2)15-9-12(25)11-24-14(22(15,3)8-6-16(26)31-21)5-7-23(4,20(24)29)18(32-24)13-10-17(27)30-19(13)28/h6,8,10,14-15,18-19,28H,5,7,9,11H2,1-4H3/t14-,15-,18-,19-,22-,23+,24+/m0/s1
SMILES [C@H]12[C@]3([C@@H](CC(=O)C[C@]41O[C@H]([C@](CC2)(C)C4=O)C1=CC(=O)O[C@@H]1O)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