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ScientificNameLabel
N-trans-Feruloyltyramine
PHCD compound ID : 1316
Chemical Names :
N-trans-feruloyl tyramine , N-trans-Feruloyltyramine
Molecular Formula : C18H19N1O4
Molecular Weight : 313.131408
More Details :
Names & Synonyms: (E)-3-(4-hydroxy-3-methoxy-phenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide , (E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]-2-propenamide , (E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide , (E)-N-[2-(4-hydroxyphenyl)ethyl]-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enamide , (E)-3-(4-hydroxy-3-methoxy-phenyl)-N-[2-(4-hydroxyphenyl)ethyl]acrylamide
Smiles: COc1cc(/C=C/C(=O)NCCc2ccc(cc2)O)ccc1O
InChi : InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+
InChi Key : InChIKey=NPNNKDMSXVRADT-WEVVVXLNSA-N
PubChem ID : 5280537
Rotatable bond count : 7 Rule of five : 0
Hydrogen bond acceptor count : 5 Ionization potential : 8.751790
Hydrogen bond donor count : 3 Electric dipole moment : 2.735
XLogP : 1.106 VDW volume : 298.437262
Molecular weight : 313.131408 HOMO-LUMO gap : 8.220000
Herb list :
Refrences & Litretures:
  
139.      Journal:'Res. J. Seed Sci'      Year:'2010'      Volume:'3'      Page:'210'      DOI:''      Title:'Bioactive Non-alkaloidal Secondary Metabolites of Hyoscyamus niger Linn. Seeds: A Review'
309.      Journal:'BioMed Research International'      Year:'2015'      Volume:''      Page:'925631'      DOI:'10.1155/2015/925631'      Title:'Portulaca oleracea L.: A Review of Phytochemistry and Pharmacological Effects'
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