CHEBI:85300 - N1,N8-bis(sinapoyl)-spermidine

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ChEBI Name N1,N8-bis(sinapoyl)-spermidine
ChEBI ID CHEBI:85300
ChEBI ASCII Name N(1),N(8)-bis(sinapoyl)-spermidine
Definition A secondary amino compound that is spermidine in which each of the primary amino groups has been mono-acylated by formal condensation with trans-sinapic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C29H39N3O8
Net Charge 0
Average Mass 557.63530
Monoisotopic Mass 557.27372
InChI InChI=1S/C29H39N3O8/c1-37-22-16-20(17-23(38-2)28(22)35)8-10-26(33)31-14-6-5-12-30-13-7-15-32-27(34)11-9-21-18-24(39-3)29(36)25(19-21)40-4/h8-11,16-19,30,35-36H,5-7,12-15H2,1-4H3,(H,31,33)(H,32,34)/b10-8+,11-9+
InChIKey PMOOGLRNGWRADJ-GFULKKFKSA-N
SMILES COc1cc(\C=C\C(=O)NCCCCNCCCNC(=O)\C=C\c2cc(OC)c(O)c(OC)c2)cc(OC)c1O
Metabolite of Species Details
Arabidopsis (NCBI:txid3701) Found in seed (BTO:0001226). See: PubMed
Hippeastrum (NCBI:txid4695) Found in pollen (BTO:0001097). See: DOI
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) has functional parent trans-sinapic acid (CHEBI:15714)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) has functional parent spermidine (CHEBI:16610)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) has role plant metabolite (CHEBI:76924)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) is a aromatic ether (CHEBI:35618)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) is a enamide (CHEBI:51751)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) is a polyphenol (CHEBI:26195)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) is a secondary amino compound (CHEBI:50995)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) is a secondary carboxamide (CHEBI:140325)
N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300) is conjugate base of N1,N8-bis(sinapoyl)-spermidine(1+) (CHEBI:85006)
Incoming N1,N8-bis(sinapoyl)-spermidine(1+) (CHEBI:85006) is conjugate acid of N1,N8-bis(sinapoyl)-spermidine (CHEBI:85300)
Registry Number Type Source
8095708 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
19168716 PubMed citation Europe PMC
Last Modified
07 March 2018