input word = C00048405

Metabolite InformationStructural formula
Name Heitziethanoid B
Formula C48H88O3
Mw 712.67334667
CAS RN 1193250-25-7
C_ID C00048405 ,
InChIKey AUUYOWKYLNLIJN-UHFFFAOYSA-N
InChICode InChI=1S/C48H88O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-48(50)51-45-44-46-40-42-47(49)43-41-46/h40-43,49H,2-39,44-45H2,1H3
SMILES c1c(ccc(c1)CCOC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeFagara heitzii Ref.
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