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CHEBI:61514 - N1,N5,N10-tri-p-coumaroyl spermidine

ChEBI IDCHEBI:61514
ChEBI NameN1,N5,N10-tri-p-coumaroyl spermidine
Stars
ASCII NameN(1),N(5),N(10)-tri-p-coumaroyl spermidine
DefinitionA spermidine hydroxycinnamic acid conjugate in which each nitrogen of spermidine has entered into amide bond formation with a molecule of 4-coumaric acid.
Last Modified23 October 2024
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC34H37N3O6
Net Charge0
Average Mass583.685
Monoisotopic Mass583.26824
SMILES[H]C(=Cc1ccc(O)cc1)C(=O)NCCCCN(CCCNC(=O)C([H])=Cc1ccc(O)cc1)C(=O)C([H])=Cc1ccc(O)cc1
InChIInChI=1S/C34H37N3O6/c38-29-13-4-26(5-14-29)10-19-32(41)35-22-1-2-24-37(34(43)21-12-28-8-17-31(40)18-9-28)25-3-23-36-33(42)20-11-27-6-15-30(39)16-7-27/h4-21,38-40H,1-3,22-25H2,(H,35,41)(H,36,42)
InChIKeyPFDVWJCSCYDRMZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514) has functional parent 4-coumaric acid (CHEBI:36090)
N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514) is a enamide (CHEBI:51751)
N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514) is a phenols (CHEBI:33853)
N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514) is a secondary carboxamide (CHEBI:140325)
N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514) is a spermidine hydroxycinnamic acid conjugate (CHEBI:61233)
N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514) is a tertiary carboxamide (CHEBI:140326)
Incoming Relation(s)
N1,N5,N10-(E)-tri-p-coumaroylspermidine (CHEBI:232336) is a N1,N5,N10-tri-p-coumaroyl spermidine (CHEBI:61514)
IUPAC Name 
3-(4-hydroxyphenyl)-N-(4-{[3-(4-hydroxyphenyl)prop-2-enoyl]amino}butyl)-N-(3-{[3-(4-hydroxyphenyl)prop-2-enoyl]amino}propyl)prop-2-enamide
Synonyms  Source
tricoumaroyl spermidineChEBI
N1,N5,N10-tri-(4-coumaroyl)spermidineChEBI
N1,N5,N10-tri-p-coumaroylspermidineChEBI
N1,N5,N10-tricoumaroylspermidineChEBI
N1,N5,N10-tricoumaroyl spermidineChEBI
N1,N5,N10-tri-4-coumaroyl spermidineChEBI
Manual XrefsDatabases
C18069KEGG COMPOUND
HMDB0304518HMDB
Citations