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The Drug Ontology
Last uploaded:
December 20, 2024
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| Preferred Name | olaparib | |
| Synonyms |
AZD-2281 AZD2281 KU59436 Lynparza olaparib 4-(3-{[4-(cyclopropylcarbonyl)piperazin-1-yl]carbonyl}-4-fluorobenzyl)phthalazin-1(2H)-one |
|
| Definitions |
A member of the class of N-acylpiperazines obtained by formal condensation of the carboxy group of 2-fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoic acid with the free amino group of N-(cyclpropylcarbonyl)piperazine; used to treat advanced ovarian cancer. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_83766 |
|
| alternative label |
AZD-2281 AZD2281 KU59436 Lynparza olaparib 4-(3-{[4-(cyclopropylcarbonyl)piperazin-1-yl]carbonyl}-4-fluorobenzyl)phthalazin-1(2H)-one
|
|
| charge |
0
|
|
| database_cross_reference |
LINCS:LSM-1145 Wikipedia:Olaparib PMID:25025963 PMID:24827126 PMID:25275045 PMID:24694947 PMID:24826054 PMID:25072752 PDBeChem:09L PMID:24817481 PMID:24700236 PMID:24534203 KEGG:D09730 PMID:24038812 PMID:25573533 Reaxys:12051534 PMID:25483710 PMID:22454224 PMID:24631446 PMID:25566684 PMID:25404465 Drug_Central:4907 PMID:25218906 CAS:763113-22-0 PMID:24356813 PMID:25139258 PMID:24577941 PMID:18800822 PMID:25531448
|
|
| definition |
A member of the class of N-acylpiperazines obtained by formal condensation of the carboxy group of 2-fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoic acid with the free amino group of N-(cyclpropylcarbonyl)piperazine; used to treat advanced ovarian cancer.
|
|
| formula |
C24H23FN4O3
|
|
| has characteristic |
http://purl.obolibrary.org/obo/CHEBI_35610 |
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_35610 |
|
| has_exact_synonym |
4-(3-{[4-(cyclopropylcarbonyl)piperazin-1-yl]carbonyl}-4-fluorobenzyl)phthalazin-1(2H)-one
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
AZD-2281 AZD2281 KU59436 Lynparza olaparib
|
|
| has_RxCUI |
1597582
|
|
| id |
CHEBI:83766
|
|
| in_subset | ||
| inchi |
InChI=1S/C24H23FN4O3/c25-20-8-5-15(14-21-17-3-1-2-4-18(17)22(30)27-26-21)13-19(20)24(32)29-11-9-28(10-12-29)23(31)16-6-7-16/h1-5,8,13,16H,6-7,9-12,14H2,(H,27,30)
|
|
| inchikey |
FDLYAMZZIXQODN-UHFFFAOYSA-N
|
|
| label |
olaparib
|
|
| mass |
434.46280
|
|
| monoisotopicmass |
434.17542
|
|
| notation |
CHEBI:83766
|
|
| prefLabel |
olaparib
|
|
| smiles |
Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)C(=O)C1CC1
|
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_38768 http://purl.obolibrary.org/obo/CHEBI_46844 |
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