dabigatran etexilate
CHEBI:CHEBI_70746
Definition
An aromatic amide obtained by formal condensation of the carboxy group of 2-{[(4-{N'-[(hexyloxy)carbonyl]carbamimidoyl}phenyl)amino]methyl}-1-methyl-1H-benzimidazole-5-carboxylic acid with the secondary amino group of ethyl N-pyridin-2-yl-beta-alaninate. A prodrug for dabigatran, a thrombin inhibitor and anticoagulant which is used for the prevention of stroke and systemic embolism.
Chemical Information
- Molecular Formula
- C34H41N7O5
- Molecular Mass
- 627.73320
- Charge
- 0
- SMILES
- CCCCCCOC(=O)\N=C(\N)c1ccc(NCc2nc3cc(ccc3n2C)C(=O)N(CCC(=O)OCC)c2ccccn2)cc1
- InChI
- InChI=1S/C34H41N7O5/c1-4-6-7-10-21-46-34(44)39-32(35)24-12-15-26(16-13-24)37-23-30-38-27-22-25(14-17-28(27)40(30)3)33(43)41(20-18-31(42)45-5-2)29-11-8-9-19-36-29/h8-9,11-17,19,22,37H,4-7,10,18,20-21,23H2,1-3H3,(H2,35,39,44)
- InChIKey
- KSGXQBZTULBEEQ-UHFFFAOYSA-N
Alternative Names
- dabigatran etexilate
- ethyl N-[(2-{[(4-{N'-[(hexyloxy)carbonyl]carbamimidoyl}phenyl)amino]methyl}-1-methyl-1H-benzimidazol-5-yl)carbonyl]-N-pyridin-2-yl-beta-alaninate
Drug Classification
-
pyridinesView Class →
CHEBI:26421
-
aromatic amideView Class →
CHEBI:62733
-
benzimidazolesView Class →
CHEBI:22715
-
carboxylic esterView Class →
CHEBI:33308
-
beta-alanine derivativeView Class →
CHEBI:22823
-
carboxamidineView Class →
CHEBI:35359
-
t275510
-
t275708
-
t275983
-
t276627
-
t276635
Important Medical Information
⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.
- Always consult with a healthcare professional before starting, stopping, or modifying any medication.
- Side effects may vary and this list may not be comprehensive.
- Drug interactions may occur with other medications.
Additional Identifiers
- DRON_00010000
- 1037042
- oboInOwl#hasDbXref
- Reaxys:15496119
- core#notation
- CHEBI:70746
Additional References
🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.
Additional Attributes
- rxcui
- 2590637
- listing_expiration_date
- 20251231
- route
- ORAL
- package_marketing_start_date
- 20200506
- marketing_start_date
- 20240812
- manufacturer_name
- Ascend Laboratories, LLC
- spl_id
- 10cf4141-989e-4d64-b3e7-a96851fe73da
- package_ndc
- 67877-474-60
- package_description
- 60 CAPSULE, COATED PELLETS in 1 BOTTLE (67877-474-60)
- oboInOwl#hasOBONamespace
- chebi_ontology
- DRON_00010000
- 1037042
- oboInOwl#hasDbXref
- Reaxys:15496119
- oboInOwl#id
- CHEBI:70746
- generic_name
- DABIGATRAN ETEXILATE
- brand_name
- Pradaxa
- brand_name_base
- Pradaxa
- product_type
- HUMAN PRESCRIPTION DRUG
- marketing_category
- ANDA
- dosage_form
- CAPSULE, COATED PELLETS
- labeler_name
- Ascend Laboratories, LLC
- application_number
- ANDA208070
- product_ndc
- 67877-474
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_65232
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- chebi#has_functional_parent
- http://purl.obolibrary.org/obo/CHEBI_70752
- chebi#is_conjugate_base_of
- http://purl.obolibrary.org/obo/CHEBI_70751
- core#notation
- CHEBI:70746
- active_ingredient_strength
- 110 mg/1
- pharm_class
- Thrombin Inhibitors [MoA]
- active_ingredient_name
- DABIGATRAN ETEXILATE MESYLATE
- unii
- SC7NUW5IIT
- spl_set_id
- 834a3c5f-b723-4bcb-a560-dc305dd0d829
- upc
- 0362332634606
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- rdf-schema#domain
- https://w3id.org/def/predibionto#has_side_effect33199
- chebi#is_conjugate_acid_of
- http://purl.obolibrary.org/obo/CHEBI_70751
- owl#annotatedSource
- t276819
- owl#someValuesFrom
- t3862177