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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:3-(2-ethylhexoxy)propan-1-amine
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Accession:CHEBI:194207 term browser browse the term
Definition:A primary aliphatic amine that is 3-aminopropan-1-ol in which the hydroxy group is replaced by a (2-ethylhexyl)oxy group.
Synonyms:exact_synonym: 3-[(2-ethylhexyl)oxy]propan-1-amine
 related_synonym: 2-ethylhexyl 3-aminopropyl ether;   3-((2-ethylhexyl)oxy)propylamine;   3-(2-ethylhexoxy)propylamine;   3-(2-ethylhexyloxy)-1-propanamine;   3-(2-ethylhexyloxy)propylamine;   3-[(2-ethylhexyl)oxy]-1-propanamine;   Formula=C11H25NO;   InChI=1S/C11H25NO/c1-3-5-7-11(4-2)10-13-9-6-8-12/h11H,3-10,12H2,1-2H3;   InChIKey=DVFGEIYOLIFSRX-UHFFFAOYSA-N;   PA-12EH;   SMILES=CCCCC(CC)COCCCN;   n-propanolamine 2-ethylhexyl ether
 xref: CAS:5397-31-9;   PMID:36237735;   Reaxys:1740535



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Term Annotations click to browse term
  CHEBI ontology 19904
    role 19875
      application 19718
        NMR chemical shift reference compound 18094
          ammonia 17892
            organic amino compound 17892
              primary amino compound 9358
                3-(2-ethylhexoxy)propan-1-amine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19904
    subatomic particle 19902
      composite particle 19902
        hadron 19902
          baryon 19902
            nucleon 19902
              atomic nucleus 19902
                atom 19902
                  main group element atom 19841
                    main group molecular entity 19841
                      s-block molecular entity 19675
                        hydrogen molecular entity 19657
                          hydrides 19165
                            inorganic hydride 18180
                              pnictogen hydride 18170
                                nitrogen hydride 18083
                                  azane 17893
                                    ammonia 17892
                                      organic amino compound 17892
                                        amine 8309
                                          primary amine 6373
                                            3-aminopropan-1-ol 0
                                              3-(2-ethylhexoxy)propan-1-amine 0
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