input word = C00054014

Metabolite InformationStructural formula
Name N1,N10-Diferuloylspermidine
Formula C27H35N3O6
Mw 497.25258587
CAS RN 70185-61-4
C_ID C00054014
InChIKey IGHVUFYLAJSILE-QHKWOANTSA-N
InChICode InChI=1S/C27H35N3O6/c1-35-24-18-20(6-10-22(24)31)8-12-26(33)29-16-4-3-14-28-15-5-17-30-27(34)13-9-21-7-11-23(32)25(19-21)36-2/h6-13,18-19,28,31-32H,3-5,14-17H2,1-2H3,(H,29,33)(H,30,34)/b12-8+,13-9+
SMILES OC1=C(OC)C=C(/C=C/C(NCCCNCCCCNC(/C=C/C2=CC(OC)=C(O)C=C2)=O)=O)C=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBetulaceaeCorylus avellana Ref.
PlantaeBromeliaceaeAnanas comosus Ref.
PlantaeFabaceaeVicia faba Ref.
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OrganismVicia faba
ReferenceAldrich Library of FT-IR Spectra, 1st edn.,1985, 1, 309D

310A (ir)