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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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  CHEBI ontology 0
    chemical entity 0
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        mixture 0
          racemate 0
            bupivacaine hydrochloride (anhydrous) 0
              bupivacaine hydrochloride hydrate 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      halogen 0
                        chlorine atom 0
                          chlorine molecular entity 0
                            elemental chlorine 0
                              monoatomic chlorine 0
                                chloride 0
                                  chloride salt 0
                                    organic chloride salt 0
                                      hydrochloride 0
                                        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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