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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:bexagliflozin
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Accession:CHEBI:229225 term browser browse the term
Definition:A C-glycosyl comprising of beta-D-glucose in which the anomeric hydroxy group is replaced by a 4-chloro-3-({4-[2-(cyclopropyloxy)ethoxy]phenyl}methyl)phenyl group. It is a sodium-glucose co-transporter 2 (SGLT2) inhibitor indicated as an adjunct to diet and exercise to improve glycemic control in adults with type 2 diabetes mellitus.
Synonyms:exact_synonym: (1S)-1,5-anhydro-1-(4-chloro-3-{4-[2-(cyclopropyloxy)ethoxy]benzyl}phenyl)-D-glucitol
 related_synonym: (1S)-1,5-anhydro-1-C-[4-chloro-3-[[4-[2-(cyclopropyloxy)ethoxy]phenyl]methyl]phenyl]-D-glucitol;   (2S,3R,4R,5S,6R)-2-(4-chloro-3-{4-[2-(cyclopropyloxy)ethoxy]benzyl}phenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol;   (2S,3R,4R,5S,6R)-2-[4-chloro-3-({4-[2-(cyclopropyloxy)ethoxy]phenyl}methyl)phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol;   Brenzavvy;   EGT-1442;   EGT0001442;   EGT1442;   Formula=C24H29ClO7;   InChI=1S/C24H29ClO7/c25-19-8-3-15(24-23(29)22(28)21(27)20(13-26)32-24)12-16(19)11-14-1-4-17(5-2-14)30-9-10-31-18-6-7-18/h1-5,8,12,18,20-24,26-29H,6-7,9-11,13H2/t20-,21-,22+,23-,24+/m1/s1;   InChIKey=BTCRKOKVYTVOLU-SJSRKZJXSA-N;   SMILES=OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)C1=CC=C(Cl)C(CC2=CC=C(OCCOC3CC3)C=C2)=C1;   THR 1442;   THR1442;   bexagliflozina;   bexagliflozine;   bexagliflozinum
 xref: CAS:1118567-05-7;   DrugBank:DB12236;   KEGG:D10865
 xref_mesh: MESH:C000705992
 xref: PMID:21215314;   PMID:31101403;   PMID:31161692;   PMID:31297965;   PMID:31432741;   PMID:31749238;   PMID:34292100;   PMID:34975223;   PMID:35773042;   PMID:36178197;   PMID:36867399;   PMID:36929659;   PMID:37148170;   PMID:37409573;   PMID:37509724;   PMID:37568270;   PMID:37651295;   PMID:37748011;   PMID:37817422;   PMID:38151752;   PMID:38230346;   PMID:38584148;   Wikipedia:Bexagliflozin



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bexagliflozin term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Slc5a2 solute carrier family 5 member 2 decreases activity ISO bexagliflozin results in decreased activity of SLC5A2 protein CTD PMID:21215314 PMID:36867399 NCBI chr 1:192,277,621...192,283,742 JBrowse link
G Ugt1a9 UDP glucuronosyltransferase family 1 member A9 increases metabolic processing ISO UGT1A9 protein results in increased metabolism of bexagliflozin CTD PMID:36867399 NCBI chr 9:96,144,786...96,256,264 JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19898
    role 19869
      biological role 19867
        inhibitor 18949
          sodium-glucose transport protein subtype 2 inhibitor 76
            bexagliflozin 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19898
    subatomic particle 19896
      composite particle 19896
        hadron 19896
          baryon 19896
            nucleon 19896
              atomic nucleus 19896
                atom 19896
                  main group element atom 19835
                    p-block element atom 19835
                      carbon group element atom 19774
                        carbon atom 19770
                          organic molecular entity 19770
                            heteroorganic entity 19535
                              organochalcogen compound 19296
                                organooxygen compound 19213
                                  carbohydrates and carbohydrate derivatives 15318
                                    carbohydrate 15318
                                      carbohydrate derivative 14339
                                        glycosyl compound 13082
                                          C-glycosyl compound 321
                                            bexagliflozin 2
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