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ONTOLOGY REPORT - ANNOTATIONS


Term:(1S,2R)-5-methoxy-1-methyl-2-(propylamino)tetralin
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Accession:CHEBI:64117 term browser browse the term
Definition:A secondary amino compound that consists of tetralin bearing methyl, propylamino and methoxy groups at positions 1, 2 and 5 respectively. Dopamine receptor antagonist with preferential action at presynaptic receptors (pKi values are 6.95, 6.67, 6.37, 6.21 and 6.07 at hD3. hD4, hD2S, hD2L and rD2 receptors respectively).
Synonyms:exact_synonym: (1S,2R)-5-methoxy-1-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
 related_synonym: 5-Methoxy-1-methyl-2-(n-propylamino)tetralin;   AJ-76;   Formula=C15H23NO;   InChI=1S/C15H23NO/c1-4-10-16-14-9-8-13-12(11(14)2)6-5-7-15(13)17-3/h5-7,11,14,16H,4,8-10H2,1-3H3/t11-,14+/m0/s1;   InChIKey=YGHLYBIUVOLKCV-SMDDNHRTSA-N;   SMILES=CCCN[C@@H]1CCc2c(OC)cccc2[C@@H]1C;   cis-(+)-5-methoxy-1-methyl-2-(propylamino)tetralin
 xref: CAS:85379-09-5 "ChemIDplus";   LINCS:LSM-25635
 xref_mesh: MESH:C051171
 xref: PMID:1589564 "Europe PMC";   PMID:1686769 "Europe PMC";   PMID:1867840 "Europe PMC";   PMID:2073922 "Europe PMC";   PMID:2397740 "Europe PMC";   PMID:2615920 "Europe PMC";   PMID:2880302 "Europe PMC";   PMID:3133239 "Europe PMC";   PMID:3562484 "Europe PMC";   PMID:3792447 "Europe PMC";   PMID:8103459 "Europe PMC";   PMID:8374772 "Europe PMC";   PMID:8739839 "Europe PMC";   PMID:9765337 "Europe PMC";   PMID:9928899 "Europe PMC";   Reaxys:4745495 "Reaxys"
 cyclic_relationship: is_conjugate_base_of CHEBI:64118


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(1S,2R)-5-methoxy-1-methyl-2-(propylamino)tetralin term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Drd2 dopamine receptor D2 JBrowse link 8 53,678,777 53,743,643 RGD:6480464
G Drd3 dopamine receptor D3 JBrowse link 11 61,819,102 61,883,223 RGD:6480464

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19669
    role 19613
      chemical role 19128
        environmental contaminant 18394
          naphthalene 2333
            tetralin 145
              (1S,2R)-5-methoxy-1-methyl-2-(propylamino)tetralin 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19669
    subatomic particle 19665
      composite particle 19665
        hadron 19665
          baryon 19665
            nucleon 19665
              atomic nucleus 19665
                atom 19665
                  main group element atom 19545
                    main group molecular entity 19545
                      s-block molecular entity 19329
                        hydrogen molecular entity 19319
                          hydrides 18242
                            organic hydride 17528
                              organic fundamental parent 17528
                                hydrocarbon 16935
                                  cyclic hydrocarbon 15098
                                    arene 15085
                                      polycyclic arene 14519
                                        ortho-fused polycyclic arene 9542
                                          ortho-fused bicyclic arene 2385
                                            naphthalene 2333
                                              tetralin 145
                                                (1S,2R)-5-methoxy-1-methyl-2-(propylamino)tetralin 2
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.