input word = C00048404

Metabolite InformationStructural formula
Name Heitziethanoid A
Formula C44H80O3
Mw 656.61074642
CAS RN 1193250-24-6
C_ID C00048404 ,
InChIKey XXNPILBXOYDBBZ-UHFFFAOYSA-N
InChICode InChI=1S/C44H80O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-44(46)47-41-40-42-36-38-43(45)39-37-42/h36-39,45H,2-35,40-41H2,1H3
SMILES c1c(ccc(c1)CCOC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeFagara heitzii Ref.
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