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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:bupivacaine hydrochloride (anhydrous)
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Accession:CHEBI:31322 term browser browse the term
Definition:A racemate composed of equimolar amounts of dextrobupivacaine hydrochloride and levobupivacaine hydrochloride. The monohydrate form is commonly used as a local anaesthetic.
Synonyms:exact_synonym: rac-1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride;   rac-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride
 related_synonym: 1-butyl-2-piperidylformo-2',6'-xylidide hydrochloride;   1-butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide monohydrochloride;   Formula=C18H29ClN2O;   InChI=1S/C18H28N2O.ClH/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3;/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21);1H;   InChIKey=SIEYLFHKZGLBNX-UHFFFAOYSA-N;   SMILES=Cl.CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C;   bupivacaine HCl;   bupivacaine hydrochloride;   bupivacaine monohydrochloride
 xref: CAS:18010-40-7;   PMID:22285545;   PMID:22374474;   PMID:22900785;   PMID:23229686;   PMID:23446090;   PMID:23453403;   PMID:23458225;   PMID:23487596;   PMID:7069125;   Reaxys:4048737



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Path 1
Term Annotations click to browse term
  CHEBI ontology 19899
    chemical entity 19897
      chemical substance 14426
        mixture 13744
          racemate 12132
            bupivacaine hydrochloride (anhydrous) 0
              bupivacaine hydrochloride hydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19899
    subatomic particle 19897
      composite particle 19897
        hadron 19897
          baryon 19897
            nucleon 19897
              atomic nucleus 19897
                atom 19897
                  main group element atom 19836
                    p-block element atom 19836
                      halogen 18710
                        chlorine atom 18488
                          chlorine molecular entity 18488
                            elemental chlorine 9025
                              monoatomic chlorine 9010
                                chloride 9010
                                  chloride salt 9010
                                    organic chloride salt 1109
                                      hydrochloride 738
                                        1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride 0
                                          levobupivacaine hydrochloride (anhydrous) 0
                                            bupivacaine hydrochloride (anhydrous) 0
                                              bupivacaine hydrochloride hydrate 0
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