input word = C00031912

Metabolite InformationStructural formula
Name Isorecedensolide
Formula C22H28O5
Mw 372.193674
CAS RN 740803-69-4
C_ID C00031912 ,
InChIKey NLJGDOQXTXBYON-BZFUCLQMNA-N
InChICode InChI=1S/C22H28O5/c1-6-7-14-10-16(23)27-21-15(9-8-11(2)3)20(25)18-19(24)12(4)13(5)26-22(18)17(14)21/h8,12-14,25H,6-7,9-10H2,1-5H3/t12-,13+,14-/m0/s1
SMILES c12c(c(c(c3c1[C@H](CC(=O)O3)CCC)CC=C(C)C)O)C(=O)[C@H]([C@H](O2)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum blancoi Ref.
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OrganismCalophyllum blancoi
ReferenceShen,Chem.Pharm.Bull.,52,(2004).402