loading...| Preferred Name |
ouabain |
|
| Synonyms |
3-(6-deoxy-alpha-L-mannopyranosyloxy)-1beta,5beta,11alpha,14,19-pentahydroxy-5beta-card-20(22)-enolide Ouabain 3-(alpha-L-rhamnopyranosyloxy)-1beta,5beta,11alpha,14,19-pentahydroxy-5beta-card-20(22)-enolide G-Strophanthin Ouabain anhydrous Ouabagenin L-Rhamnoside Ouabagenin-L-rhamnosid Ouabaine Oubain Strodival |
|
| Definitions |
A steroid hormone that is a multi-hydroxylated alpha-L-rhamnosyl cardenoloide. It binds to and inhibits the plasma membrane Na(+)/K(+)-ATPase (sodium pump). It has been isolated naturally from Strophanthus gratus. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_472805 |
|
| charge |
0 |
|
| database_cross_reference |
PMID:31548455 PDBeChem:OBN PMID:20372980 PMID:31170971 CAS:630-60-4 FooDB:FDB005482 KEGG:D00112 Drug_Central:2004 Wikipedia:Ouabain PMID:32569558 PMID:1316269 Beilstein:101712 KEGG:C01443 HMDB:HMDB0015224 PMID:16529963 LINCS:LSM-2781 KNApSAcK:C00003633 PMID:32368275 PMID:10438974 LIPID_MAPS_instance:LMST01120022 DrugBank:DB01092 Reaxys:101712 PMID:31986323 PMID:9872395 PMID:32488807 PMID:31075189 PMID:32326025 |
|
| definition |
A steroid hormone that is a multi-hydroxylated alpha-L-rhamnosyl cardenoloide. It binds to and inhibits the plasma membrane Na(+)/K(+)-ATPase (sodium pump). It has been isolated naturally from Strophanthus gratus. |
|
| formula |
C29H44O12 |
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_38070 http://purl.obolibrary.org/obo/CHEBI_76924 http://purl.obolibrary.org/obo/CHEBI_50184 http://purl.obolibrary.org/obo/CHEBI_49200 http://purl.obolibrary.org/obo/CHEBI_77023 http://purl.obolibrary.org/obo/CHEBI_77024 |
|
| has_alternative_id |
CHEBI:44461 CHEBI:7805 |
|
| has_exact_synonym |
3-(6-deoxy-alpha-L-mannopyranosyloxy)-1beta,5beta,11alpha,14,19-pentahydroxy-5beta-card-20(22)-enolide Ouabain |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
3-(alpha-L-rhamnopyranosyloxy)-1beta,5beta,11alpha,14,19-pentahydroxy-5beta-card-20(22)-enolide G-Strophanthin Ouabain anhydrous Ouabagenin L-Rhamnoside Ouabagenin-L-rhamnosid Ouabaine Oubain Strodival |
|
| has_RxCUI |
7762 |
|
| id |
CHEBI:472805 |
|
| in_subset | ||
| inchi |
InChI=1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1 |
|
| inchikey |
LPMXVESGRSUGHW-HBYQJFLCSA-N |
|
| is conjugate acid of | ||
| label |
Ouabain ouabain |
|
| mass |
584.65250 |
|
| monoisotopicmass |
584.28328 |
|
| notation |
CHEBI:472805 |
|
| prefLabel |
ouabain |
|
| smiles |
[H][C@@]12CC[C@]3(O)C[C@H](C[C@@H](O)[C@]3(CO)[C@@]1([H])[C@H](O)C[C@]1(C)[C@H](CC[C@]21O)C1=CC(=O)OC1)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_38195 http://purl.obolibrary.org/obo/CHEBI_36862 http://purl.obolibrary.org/obo/CHEBI_26764 http://purl.obolibrary.org/obo/CHEBI_38092 |