cangrelor
CHEBI:CHEBI_90841
Definition
A nucleoside triphosphate analogue that is 5'-O-[({[dichloro(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]adenosine carrying additional 2-(methylsulfanyl)ethyl and (3,3,3-trifluoropropyl)sulfanyl substituents at positions N6 and C2 respectively. Used (in the form of its tetrasodium salt) as an intravenous antiplatelet drug that prevents formation of harmful blood clots in the coronary arteries.
Chemical Information
- Molecular Formula
- C17H25Cl2F3N5O12P3S2
- Molecular Mass
- 776.362
- Charge
- 0
- SMILES
- C1(=NC(=C2C(=N1)N(C=N2)[C@@H]3O[C@@H]([C@H]([C@H]3O)O)COP(OP(C(P(O)(=O)O)(Cl)Cl)(=O)O)(=O)O)NCCSC)SCCC(F)(F)F
- InChI
- InChI=1S/C17H25Cl2F3N5O12P3S2/c1-43-5-3-23-12-9-13(26-15(25-12)44-4-2-16(20,21)22)27(7-24-9)14-11(29)10(28)8(38-14)6-37-42(35,36)39-41(33,34)17(18,19)40(30,31)32/h7-8,10-11,14,28-29H,2-6H2,1H3,(H,33,34)(H,35,36)(H,23,25,26)(H2,30,31,32)/t8-,10-,11-,14-/m1/s1
- InChIKey
- PAEBIVWUMLRPSK-IDTAVKCVSA-N
Alternative Names
- 5'-O-[({[dichloro(phosphono)methyl](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-N-[2-(methylsulfanyl)ethyl]-2-[(3,3,3-trifluoropropyl)sulfanyl]adenosine
- cangrelor
Drug Classification
-
adenosine 5'-phosphateView Class →
CHEBI:37096
-
organochlorine compoundView Class →
CHEBI:36683
-
organofluorine compoundView Class →
CHEBI:37143
-
secondary amino compoundView Class →
CHEBI:50995
-
aryl sulfideView Class →
CHEBI:35683
-
nucleoside triphosphate analogueView Class →
CHEBI:37413
-
t316594
-
t316620
-
t316940
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
- oboInOwl#hasDbXref
- Wikipedia:Cangrelor
- DRON_00010000
- 1656052
- core#notation
- CHEBI:90841
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
- oboInOwl#hasOBONamespace
- chebi_ontology
- oboInOwl#hasDbXref
- Wikipedia:Cangrelor
- DRON_00010000
- 1656052
- oboInOwl#id
- CHEBI:90841
- core#notation
- CHEBI:90841
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_50427
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- chebi#is_conjugate_acid_of
- http://purl.obolibrary.org/obo/CHEBI_90843
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- has_treatment
- http://purl.obolibrary.org/obo/DOID_5844
- rdf-schema#domain
- https://w3id.org/def/predibionto#has_side_effect37991
- chebi#is_conjugate_base_of
- http://purl.obolibrary.org/obo/CHEBI_90843
- owl#someValuesFrom
- t2998927
- owl#annotatedSource
- t317861