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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:carbamazepine-10,11-epoxide
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Accession:CHEBI:3388 term browser browse the term
Definition:An epoxide and metabolite of carbamazepine.
Synonyms:exact_synonym: 1a,10b-dihydro-6H-dibenzo[b,f]oxireno[d]azepine-6-carboxamide
 related_synonym: 10,11-Epoxycarbamazepine;   Carbamazepine 10,11-oxide;   Carbamazepine epoxide;   Formula=C15H12N2O2;   InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18);   InChIKey=ZRWWEEVEIOGMMT-UHFFFAOYSA-N;   SMILES=NC(=O)N1c2ccccc2C2OC2c2ccccc12
 xref: Beilstein:1219988;   CAS:36507-30-9;   HMDB:HMDB0060658;   KEGG:C07496
 xref_mesh: MESH:C012227
 xref: PMID:22322005;   PMID:22443929;   PMID:24632353;   PMID:7233491;   Reaxys:1219988


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carbamazepine-10,11-epoxide term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Alb albumin affects binding ISO carbamazepine epoxide binds to ALB protein CTD PMID:28562019 NCBI chr14:17,607,397...17,622,814
Ensembl chr14:17,607,381...17,622,836
JBrowse link
G Cyp2c79 cytochrome P450, family 2, subfamily c, polypeptide 79 affects chemical synthesis
multiple interactions
ISO CYP2C8 protein affects the chemical synthesis of carbamazepine epoxide
Probenecid promotes the reaction [CYP2C8 protein affects the chemical synthesis of carbamazepine epoxide]
CTD PMID:15915352
G Cyp3a2 cytochrome P450, family 3, subfamily a, polypeptide 2 multiple interactions
affects chemical synthesis
ISO [CYP3A4 protein results in increased metabolism of Carbamazepine] which results in increased chemical synthesis of carbamazepine epoxide; Felbamate affects the reaction [[CYP3A4 protein results in increased metabolism of Carbamazepine] which results in increased chemical synthesis of carbamazepine epoxide]; Probenecid promotes the reaction [CYP3A4 protein affects the chemical synthesis of carbamazepine epoxide] CTD PMID:12606595 PMID:15915352 NCBI chr12:9,207,986...9,230,038
Ensembl chr12:9,015,383...9,285,008
JBrowse link
G Ephx1 epoxide hydrolase 1 multiple interactions ISO [EPHX1 gene SNP affects the metabolism of carbamazepine epoxide] which affects the chemical synthesis of 10,11-dihydro-10,11-dihydroxy-5H-dibenzazepine-5-carboxamide; [EPHX1 protein results in increased metabolism of carbamazepine epoxide] which results in increased chemical synthesis of 10,11-dihydro-10,11-dihydroxy-5H-dibenzazepine-5-carboxamide CTD PMID:15692831 NCBI chr13:92,714,315...92,744,124
Ensembl chr13:92,714,315...92,790,235
JBrowse link
G Gstp1 glutathione S-transferase pi 1 affects binding ISO carbamazepine epoxide binds to GSTP1 protein CTD PMID:28562019 NCBI chr 1:201,337,762...201,340,230
Ensembl chr 1:201,321,672...201,340,226
JBrowse link
G Nr1i2 nuclear receptor subfamily 1, group I, member 2 increases activity ISO carbamazepine epoxide results in increased activity of NR1I2 protein CTD PMID:17112801 NCBI chr11:62,460,213...62,496,665
Ensembl chr11:62,460,213...62,496,658
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19812
    role 19761
      biological role 19761
        xenobiotic 18442
          carbamazepine 2029
            carbamazepine-10,11-epoxide 6
Path 2
Term Annotations click to browse term
  CHEBI ontology 19812
    subatomic particle 19811
      composite particle 19811
        hadron 19811
          baryon 19811
            nucleon 19811
              atomic nucleus 19811
                atom 19811
                  main group element atom 19708
                    p-block element atom 19708
                      carbon group element atom 19630
                        carbon atom 19620
                          organic molecular entity 19620
                            organic group 18728
                              organic divalent group 18719
                                organodiyl group 18719
                                  carbonyl group 18667
                                    carbonyl compound 18667
                                      carboxylic acid 18364
                                        carboacyl group 17482
                                          univalent carboacyl group 17482
                                            carbamoyl group 17298
                                              carboxamide 17298
                                                monocarboxylic acid amide 15014
                                                  urea 5112
                                                    ureas 5109
                                                      carbamazepine 2029
                                                        carbamazepine-10,11-epoxide 6
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