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The Drug-Drug Interactions Ontology
| Preferred Name | spironolactone | |
| Synonyms |
spironolattone spironolactonum espironolactona spironolactone C24H32O4S Spironolactone 7alpha-(acetylsulfanyl)-3-oxo-17alpha-pregn-4-ene-21,17-carbolactone (1'S,2R,2'R,9'R,10'R,11'S,15'S)-9'-(acetylsulfanyl)-2',15'-dimethylspiro[oxolane-2,14'-tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan]-6'-ene-5,5'-dione |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_9241 |
|
| AHFScode |
24:32.20
|
|
| ATCCode |
C03DA01
|
|
| binds |
http://purl.obolibrary.org/obo/dinto_2667 http://purl.obolibrary.org/obo/dinto_1987 http://purl.obolibrary.org/obo/dinto_1440 http://purl.obolibrary.org/obo/dinto_1221 http://purl.obolibrary.org/obo/dinto_0887 |
|
| blocks | ||
| CASRN |
52-01-7
|
|
| DBBrand |
spiresis duraspiron euteberol aldace abbolactone sincomen spiroctan nefurofan spiridon sprioderm spironolactone a snl spirone lacdene aldactazide sagisal melarcon laractone spirolactone uractone suracton verospirone opianin verospirone spiroctanie diatensec alderon spironocompren spironolattone [dcit] spiroderm acelat spironolactone [ban:inn:jan] aldactone a aquareduct osyrol xenalon altex supra-puren urusonin aldactone aldactide espironolactona [inn-spanish] lacalmin almatol spironolactonum [inn-latin] spiretic dira deverol spiro-tablinen spirolang spirolone verospiron spirolakton aldopur
|
|
| DBname |
spironolactone
|
|
| Definition |
A steroid lactone that has formula C24H32O4S.
|
|
| has effect |
http://purl.obolibrary.org/obo/OAE_0000377 http://purl.obolibrary.org/obo/OAE_0000376 http://purl.obolibrary.org/obo/OAE_0001046 http://purl.obolibrary.org/obo/OAE_0000600 http://purl.obolibrary.org/obo/OAE_0000920 http://purl.obolibrary.org/obo/OAE_0000601 http://purl.obolibrary.org/obo/OAE_0000268 http://purl.obolibrary.org/obo/OAE_0000584 http://purl.obolibrary.org/obo/OAE_0000542 http://purl.obolibrary.org/obo/OAE_0000968 http://purl.obolibrary.org/obo/OAE_0000275 http://purl.obolibrary.org/obo/OAE_0000362 http://purl.obolibrary.org/obo/OAE_0000565 http://purl.obolibrary.org/obo/OAE_0001001 |
|
| has pharmacological target | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_35498 |
|
| InChI |
InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1
|
|
| InChIKey |
InChIKey=LXMSZDCAJNLERA-ZHYRCANASA-N
|
|
| induces | ||
| inhibits |
http://purl.obolibrary.org/obo/dinto_2667 http://purl.obolibrary.org/obo/dinto_1987 |
|
| label |
spironolactone
|
|
| may interact with |
http://purl.obolibrary.org/obo/dinto_DB00519 http://purl.obolibrary.org/obo/CHEBI_4551 http://purl.obolibrary.org/obo/CHEBI_9434 http://purl.obolibrary.org/obo/CHEBI_8024 http://purl.obolibrary.org/obo/CHEBI_5959 http://purl.obolibrary.org/obo/dinto_DB00648 http://purl.obolibrary.org/obo/CHEBI_6541 http://purl.obolibrary.org/obo/CHEBI_31547 http://purl.obolibrary.org/obo/CHEBI_8713 http://purl.obolibrary.org/obo/dinto_DB01340 http://purl.obolibrary.org/obo/CHEBI_8774 http://purl.obolibrary.org/obo/CHEBI_4814 http://purl.obolibrary.org/obo/CHEBI_3347 http://purl.obolibrary.org/obo/CHEBI_3380 http://purl.obolibrary.org/obo/CHEBI_5163 http://purl.obolibrary.org/obo/dinto_DB01344 http://purl.obolibrary.org/obo/CHEBI_50861 http://purl.obolibrary.org/obo/dinto_DB00684 http://purl.obolibrary.org/obo/CHEBI_3011 http://purl.obolibrary.org/obo/CHEBI_43755 http://purl.obolibrary.org/obo/CHEBI_4784 |
|
| modulates | ||
| prefixIRI |
obo2:CHEBI_9241
|
|
| prefLabel |
spironolactone
|
|
| SMILES |
[H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@@]([H])(CC2=CC(=O)CC[C@]12C)SC(C)=O [H][C@]12CC[C@@]3(C)[C@@]([H])(CC[C@@]33CCC(=O)O3)[C@]1([H])[C@@H](CC1=CC(=O)CC[C@]21C)SC(C)=O
|
|
| Synonym |
spironolattone spironolactonum espironolactona spironolactone C24H32O4S Spironolactone 7alpha-(acetylsulfanyl)-3-oxo-17alpha-pregn-4-ene-21,17-carbolactone (1'S,2R,2'R,9'R,10'R,11'S,15'S)-9'-(acetylsulfanyl)-2',15'-dimethylspiro[oxolane-2,14'-tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan]-6'-ene-5,5'-dione
|
|
| xref |
Beilstein:57767 DrugBank:DB00421 Patent:US3013012 PDB:SNL KEGG COMPOUND:C07310 PharmGKB:PA451483 Drugs Product Database (DPD):613223 National Drug Code Directory:0781-1599-01 PubChem Substance:46508525 ChemSpider:5628 KEGG DRUG:D00443 Guide To Pharmacology:2875 PDRhealth:http://www.pdrhealth.com/drug_info/rxdrugprofiles/drugs/ald1010.shtml Wikipedia:http://en.wikipedia.org/wiki/Spironolactone IUPHAR:2875 RxList:http://www.rxlist.com/cgi/generic/spiron.htm Drugs.com:http://www.drugs.com/spironolactone.html ChEBI:9241 BindingDB:50228080 PubChem Compound:5833 CASRN:52-01-7
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| subClassOf |
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