input word = C00044569

Metabolite InformationStructural formula
Name Brasimarin A
Formula C24H22O5
Mw 390.14672381
CAS RN 514214-45-0
C_ID C00044569 ,
InChIKey QWYOEBGEICIGCR-UHFFFAOYSA-N
InChICode InChI=1S/C24H22O5/c1-4-8-15-13-17(25)28-23-18(15)22-16(11-12-24(2,3)29-22)21(27)19(23)20(26)14-9-6-5-7-10-14/h5-7,9-13,27H,4,8H2,1-3H3
SMILES CCCc1cc(=O)oc2c(C(=O)c3ccccc3)c(O)c3c(c12)OC(C)(C)C=C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum brasiliense Ref.
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