input word = C00042454

Metabolite InformationStructural formula
Name Defuscin
Formula C38H68O3
Mw 572.51684604
CAS RN 120727-03-9
C_ID C00042454 ,
InChIKey DUIIKPOJUKGTSI-LVYIWIAJSA-N
InChICode InChI=1S/C39H68O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-36-42-39(41)35-32-37-30-33-38(40)34-31-37/h30-35,40H,2-29,36H2,1H3/b35-32+
SMILES c1c(ccc(c1)/C=C/C(=O)OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis gaudichaudiana Ref.
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