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N-[(E)-sinapoyl]tyramine

PropertiesImage
MNX_IDMNXM107149 Image of MNXM107149
referencechebi:70105
formulaC19H21NO5
global charge0
mol weight343.379
InChIKeyIEDBNTAKVGBZEP-VMPITWQZSA-N
InChIInChI=1S/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+
SMILESCOC1=CC(/C=C/C(=O)NCCC2=CC=C(O)C=C2)=CC(OC)=C1O
MNX internals
InChI (mnx)InChI=1/C19H21NO5/c1-24-16-11-14(12-17(25-2)19(16)23)5-8-18(22)20-10-9-13-3-6-15(21)7-4-13/h3-8,11-12,21,23H,9-10H2,1-2H3,(H,20,22)/b8-5+ Image of MNXM107149
SMILES (mnx)[CH3:1][O:24][C:16]1=[C:19]([OH:23])[C:17]([O:25][CH3:2])=[CH:12][C:14](/[CH:5]=[CH:8]/[C:18](=[N:20]/[CH2:10][CH2:9][C:13]2=[CH:4][CH:7]=[C:15]([OH:21])[CH:6]=[CH:3]2)[OH:22])=[CH:11]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:70105
chebi:70105
IEDBNTAKVGBZEP-VMPITWQZSA-N 		N-[(E)-sinapoyl]tyramine
(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide
(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide
N-(4-hydroxyphenethyl)-3,5-dimethoxy-4-hydroxy-trans-cinnamamide
N-trans-sinapoyltyramine
trans-N-sinapoyltyramine

metacyc.compound:CPD-8942
metacycM:CPD-8942
seed.compound:cpd25502
seedM:cpd25502
IEDBNTAKVGBZEP-VMPITWQZSA-N 		sinapoyltyramine

seedM:M_cpd25502 		secondary/obsolete/fantasy identifier