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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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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 26034
    role 25961
      chemical role 24242
        emulsifier 6606
          surfactant 6599
            amphiphile 39
              levobupivacaine hydrochloride (anhydrous) 0
                bupivacaine hydrochloride (anhydrous) + 0
                levobupivacaine hydrochloride hydrate + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26034
    subatomic particle 26009
      composite particle 26009
        hadron 26020
          baryon 26009
            nucleon 26009
              atomic nucleus 26009
                atom 26009
                  main group element atom 25834
                    p-block element atom 25834
                      halogen 21140
                        chlorine atom 20244
                          chlorine molecular entity 20262
                            elemental chlorine 8461
                              monoatomic chlorine 8444
                                chloride 8444
                                  chloride salt 8451
                                    organic chloride salt 1126
                                      hydrochloride 747
                                        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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