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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:levobupivacaine hydrochloride (anhydrous)
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Accession:CHEBI:31772 term browser browse the term
Definition:The monohydrochloride salt of levobupivacaine.
Synonyms:exact_synonym: (2S)-1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride
 related_synonym: (-)-bupivacaine hydrochloride;   (2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride;   (S)-1-butyl-2',6'-pipecoloxylidide hydrochloride;   (S)-1-butyl-2',6'-pipecoloxylidide monohydrochloride;   Chirocaine;   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/t16-;/m0./s1;   InChIKey=SIEYLFHKZGLBNX-NTISSMGPSA-N;   SMILES=Cl.CCCCN1CCCC[C@H]1C(=O)Nc1c(C)cccc1C;   levobupivacaine HCl;   levobupivacaine hydrochloride;   levobupivacaine monohydrochloride
 xref: CAS:27262-48-2;   DrugBank:DB01002;   KEGG:D01287;   PMID:15223079;   PMID:15454582;   PMID:15758086;   PMID:17376254;   PMID:24005134;   Reaxys:8879953
 cyclic_relationship: is_enantiomer_of CHEBI:77442


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19831
    role 19807
      chemical role 19442
        emulsifier 6227
          surfactant 6227
            amphiphile 38
              levobupivacaine hydrochloride (anhydrous) 0
                bupivacaine hydrochloride (anhydrous) + 0
                levobupivacaine hydrochloride hydrate + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    p-block element atom 19779
                      halogen 18651
                        chlorine atom 18460
                          chlorine molecular entity 18460
                            elemental chlorine 8533
                              monoatomic chlorine 8518
                                chloride 8518
                                  chloride salt 8518
                                    organic chloride salt 1085
                                      hydrochloride 721
                                        1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride 0
                                          levobupivacaine hydrochloride (anhydrous) 0
                                            bupivacaine hydrochloride (anhydrous) + 0
                                            levobupivacaine hydrochloride hydrate + 0
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