EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:137695 - 1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid

ChEBI IDCHEBI:137695
ChEBI Name1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid
Stars
DefinitionA polyether that is 4,7,10-trioxatridecane substituted at positions 1 and 13 by an amino group and a 3-carboxypropanamido group respectively. Flexible and hydrophilic, it is used as an extended linker in solid-phase immunoassays.
Last Modified7 March 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC14H28N2O6
Net Charge0
Average Mass320.386
Monoisotopic Mass320.19474
SMILESNCCCOCCOCCOCCCNC(=O)CCC(=O)O
InChIInChI=1S/C14H28N2O6/c15-5-1-7-20-9-11-22-12-10-21-8-2-6-16-13(17)3-4-14(18)19/h1-12,15H2,(H,16,17)(H,18,19)
InChIKeyFRJNIHLOMXIQKH-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid (CHEBI:137695) is a monocarboxylic acid (CHEBI:25384)
1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid (CHEBI:137695) is a polyether (CHEBI:46774)
1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid (CHEBI:137695) is a primary amino compound (CHEBI:50994)
1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid (CHEBI:137695) is a secondary carboxamide (CHEBI:140325)
IUPAC Name 
1-amino-15-oxo-4,7,10-trioxa-14-azaoctadecan-18-oic acid
Synonyms  Source
1,13-diamino-4,7,10-trioxatridecanesuccinamic acidChEBI
1,13-diamino-4,7,10-trioxatridecansuccinamic acidChEBI
TtdsChEBI
Registry NumbersSources
Reaxys:18870896Reaxys
Citations