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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:pseudoephedrine
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Accession:CHEBI:51209 term browser browse the term
Definition:A member of the class of the class of phenylethanolamines that is (1S)-2-(methylamino)-1-phenylethan-1-ol in which the pro-S hydrogen at position 2 is replaced by a methyl group.
Synonyms:exact_synonym: (1S,2S)-2-(methylamino)-1-phenylpropan-1-ol
 related_synonym: (+) threo-2-(methylamino)-1-phenyl-1-propanol;   (+)-threo-Ephedrine;   (1S,2S)-Pseudoephedrine;   2-(Methylamino)-1-phenyl-1-propanol;   Formula=C10H15NO;   InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10+/m0/s1;   InChIKey=KWGRBVOPPLSCSI-WCBMZHEXSA-N;   Isoephedrine;   L(+)-psi-Ephedrine;   L-(+)-Pseudoephedrine;   Pseudoephedrine D-form;   Psi-ephedrin;   Psi-ephedrine;   SMILES=CN[C@@H](C)[C@@H](O)c1ccccc1;   d-Isoephedrine;   d-Pseudoephedrine;   d-psi-2-Methylamino-1-phenyl-1-propanol;   d-psi-Ephedrine;   pseudoefedrina;   pseudoephedrinum;   trans-Ephedrine
 alt_id: CHEBI:44
 xref: CAS:90-82-4;   DrugBank:DB00852;   Drug_Central:2326;   HMDB:HMDB0001943;   KEGG:C02765;   KEGG:D08449;   KNApSAcK:C00031097;   LINCS:LSM-3885;   MetaCyc:CPD-9954;   PMID:11153535;   PMID:12199969;   PMID:15532139;   PMID:16410207;   PMID:16531903;   PMID:16965375;   PMID:17230461;   PMID:17316256;   PMID:26708626;   PMID:26762956;   PMID:26888635;   PMID:27168748;   PMID:27179610;   Reaxys:2414132;   Wikipedia:Pseudoephedrine
 cyclic_relationship: is_conjugate_base_of CHEBI:132296


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19874
    role 19844
      biological role 19842
        xenobiotic 18722
          pseudoephedrine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19874
    subatomic particle 19872
      composite particle 19872
        hadron 19872
          baryon 19872
            nucleon 19872
              atomic nucleus 19872
                atom 19872
                  main group element atom 19811
                    main group molecular entity 19811
                      s-block molecular entity 19647
                        hydrogen molecular entity 19628
                          hydrides 19139
                            inorganic hydride 18156
                              pnictogen hydride 18146
                                nitrogen hydride 18059
                                  azane 17866
                                    ammonia 17865
                                      organic amino compound 17865
                                        amino alcohol 1075
                                          ethanolamines 826
                                            phenylethanolamines 608
                                              pseudoephedrine 0
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