input word = C00044816

Metabolite InformationStructural formula
Name Inophyllum D
(+)-Inophyllum D
Formula C25H24O5
Mw 404.16237388
CAS RN 41135-08-4
C_ID C00044816 ,
InChIKey BXENDTPSKAICGV-RLDLEEFENA-N
InChICode InChI=1S/C25H24O5/c1-13-14(2)28-22-16-10-11-25(3,4)30-23(16)19-17(15-8-6-5-7-9-15)12-18(26)29-24(19)20(22)21(13)27/h5-14,21,27H,1-4H3/t13-,14+,21+/m0/s1
SMILES c12C=CC(Oc1c1c(c3c2O[C@@H]([C@@H]([C@H]3O)C)C)oc(=O)cc1c1ccccc1)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum brasiliense Ref.
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OrganismCalophyllum brasiliense
ReferenceIto,J.Nat.Prod.,66,(2003),368