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ONTOLOGY REPORT - ANNOTATIONS


Term:benzoylmesaconine
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Accession:CHEBI:132630 term browser browse the term
Definition:A diterpene alkaloid with formula C31H43NO10 that is isolated from several Aconitum species.
Synonyms:exact_synonym: 3alpha,8,13,15alpha-tetrahydroxy-1alpha,6alpha,16beta-trimethoxy-4-(methoxymethyl)-20-methylaconitan-14alpha-yl benzoate
 related_synonym: (1alpha,3alpha,6alpha,14alpha,15alpha,16beta)-3,8,13,15-tetrahydroxy-1,6,16-trimethoxy-4-(methoxymethyl)-20-methylaconitan-14-yl benzoate;   14-benzoylmesaconine;   Formula=C31H43NO10;   InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16-,17-,18+,19-,20+,21+,22-,23?,24+,25-,26+,28+,29-,30+,31-/m1/s1;   InChIKey=PULWZCUZNRVAHT-IJNXHYLPSA-N;   Mesaconine 14-benzoate;   SMILES=[C@@]123C4[C@@]([C@]5([C@H]([C@@H]([C@]6(C[C@@]1([C@@]5([C@H]6OC(C=7C=CC=CC7)=O)[H])[H])O)OC)O)O)([C@@H]([C@@]2([C@]([C@@H](C[C@@H]3OC)O)(COC)CN4C)[H])OC)[H]
 xref: Beilstein:72534 "ChemIDplus";   CAS:63238-67-5 "ChemIDplus"
 xref_mesh: MESH:C085283
 xref: PMID:12543043 "Europe PMC";   PMID:22375424 "Europe PMC";   PMID:22715726 "Europe PMC";   PMID:23411001 "Europe PMC";   PMID:23707213 "Europe PMC";   PMID:24170571 "Europe PMC";   PMID:24190290 "Europe PMC";   PMID:24343604 "Europe PMC";   PMID:24380294 "Europe PMC";   PMID:24793215 "Europe PMC";   PMID:25095352 "Europe PMC";   PMID:25324527 "Europe PMC";   PMID:25329869 "Europe PMC";   PMID:25744397 "Europe PMC";   PMID:26274911 "Europe PMC";   PMID:27048641 "Europe PMC";   PMID:27183898 "Europe PMC";   PMID:27357588 "Europe PMC";   PMID:27818926 "Europe PMC";   PMID:7997462 "Europe PMC";   PMID:8282271 "Europe PMC";   PMID:9682963 "Europe PMC";   PMID:9682964 "Europe PMC";   Reaxys:23777137 "Reaxys";   Reaxys:26721269 "Reaxys";   Reaxys:72534 "Reaxys"


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benzoylmesaconine term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Abcb1a ATP binding cassette subfamily B member 1A JBrowse link 4 22,339,829 22,517,642 RGD:6480464
G Abcc2 ATP binding cassette subfamily C member 2 JBrowse link 1 263,554,426 263,612,556 RGD:6480464

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19716
    role 19663
      biological role 19661
        pharmacological role 18755
          analgesic 13051
            benzoylmesaconine 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19716
    subatomic particle 19712
      composite particle 19712
        hadron 19712
          baryon 19712
            nucleon 19712
              atomic nucleus 19712
                atom 19712
                  main group element atom 19598
                    p-block element atom 19598
                      carbon group element atom 19486
                        carbon atom 19480
                          organic molecular entity 19480
                            organic group 18407
                              organic divalent group 18397
                                organodiyl group 18397
                                  carbonyl group 18285
                                    carbonyl compound 18285
                                      carboxylic acid 17940
                                        aromatic carboxylic acid 10745
                                          benzoic acids 10711
                                            benzoate ester 3992
                                              benzoylmesaconine 2
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.