input word = C00002944

Metabolite InformationStructural formula
Name Calophyllin B
Formula C18H16O4
Mw 296.104859
CAS RN 17623-60-8
C_ID C00002944 ,
InChIKey APHJPNXEBUUMKB-UHFFFAOYSA-N
InChICode InChI=1S/C18H16O4/c1-10(2)6-7-11-8-9-12-17(21)15-13(19)4-3-5-14(15)22-18(12)16(11)20/h3-6,8-9,19-20H,7H2,1-2H3
SMILES CC(C)=CCc1ccc2c(=O)c3c(O)cccc3oc2c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum bracteatum Ref.
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum inophyllum Ref.
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