input word = C00010217

Metabolite InformationStructural formula
Name Calaustralin
Formula C25H24O5
Mw 404.16237388
CAS RN 21824-07-7
C_ID C00010217 ,
InChIKey LCHRCBXGRPWRBG-PTTDRDKLNA-N
InChICode InChI=1S/C25H24O5/c1-13(2)10-11-17-24-20(18(12-19(26)30-24)16-8-6-5-7-9-16)23(28)21-22(27)14(3)15(4)29-25(17)21/h5-10,12,14-15,28H,11H2,1-4H3/t14-,15+/m0/s1
SMILES c12c(c3c(c(cc(=O)o3)c3ccccc3)c(c1C(=O)[C@H]([C@H](O2)C)C)O)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum inophyllum Ref.
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