loading...| Preferred Name |
rivaroxaban |
|
| Synonyms |
5-chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide rivaroxaban BAY 59-7939 BAY59-7939 Xarelto |
|
| Definitions |
A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 5-chlorothiophene-2-carboxylic acid with the amino group of 4-{4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}morpholin-3-one. An anticoagulant used for prophylaxis of venous thromboembolism in patients with knee or hip replacement surgery. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_68579 |
|
| charge |
0 |
|
| database_cross_reference |
PMID:22534269 Patent:US2010151011 Drug_Central:4182 PMID:32223511 PMID:22884545 Patent:US2005182055 Patent:WO2004060887 PMID:31784708 Patent:WO2011080341 Patent:US2011152266 PMID:22533680 Patent:US2009036504 PDBeChem:RIV PMID:32382756 Patent:US2011288294 Reaxys:10206739 PMID:22542983 PMID:22932305 PMID:22871192 PMID:32519800 Patent:US2011034453 PMID:32265542 PMID:22651881 Patent:WO2012035057 PMID:22534775 LINCS:LSM-5499 PMID:23006523 PMID:22272729 PMID:32223113 PMID:22242932 PMCID:PMC7292653 PMID:22800431 Patent:US7816355 KEGG:D07086 PMID:22777255 PMID:32296145 Patent:WO2012051692 PMID:23014816 Wikipedia:Rivaroxaban CAS:366789-02-8 PMID:22173426 PMID:22958812 PMID:22187012 PMID:22664783 PMID:32252075 DrugBank:DB06228 PMID:22811404 PMID:30653475 PMID:22042412 PMID:22422332 Patent:US2007026065 PMID:32002769 PMID:32023227 PMID:32548552 PMID:32548556 PMID:22740145 PMID:22387577 Patent:WO2008140220 PMID:22701330 PMID:22372178 Patent:US2011112083 PMID:32279215 Patent:WO2005068456 Patent:EP1685841 |
|
| formula |
C19H18ClN3O5S |
|
| has role | ||
| has_exact_synonym |
5-chloro-N-({(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl}methyl)thiophene-2-carboxamide |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
rivaroxaban BAY 59-7939 BAY59-7939 Xarelto |
|
| has_RxCUI |
1114195 |
|
| id |
CHEBI:68579 |
|
| in_subset | ||
| inchi |
InChI=1S/C19H18ClN3O5S/c20-16-6-5-15(29-16)18(25)21-9-14-10-23(19(26)28-14)13-3-1-12(2-4-13)22-7-8-27-11-17(22)24/h1-6,14H,7-11H2,(H,21,25)/t14-/m0/s1 |
|
| inchikey |
KGFYHTZWPPHNLQ-AWEZNQCLSA-N |
|
| label |
rivaroxaban |
|
| mass |
435.880 |
|
| monoisotopicmass |
435.06557 |
|
| notation |
CHEBI:68579 |
|
| prefixIRI |
CHEBI:68579 |
|
| prefLabel |
rivaroxaban |
|
| smiles |
O1CC(N(CC1)C2=CC=C(C=C2)N3C[C@@H](OC3=O)CNC(C=4SC(=CC4)Cl)=O)=O |
|
| textual definition |
A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 5-chlorothiophene-2-carboxylic acid with the amino group of 4-{4-[(5S)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl}morpholin-3-one. An anticoagulant used for prophylaxis of venous thromboembolism in patients with knee or hip replacement surgery. |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_26961 http://purl.obolibrary.org/obo/CHEBI_62733 http://purl.obolibrary.org/obo/CHEBI_36683 http://purl.obolibrary.org/obo/CHEBI_55374 http://purl.obolibrary.org/obo/CHEBI_24995 |