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CHEBI:145799 - ouabagenin(1−)

ChEBI IDCHEBI:145799
ChEBI Nameouabagenin(1−)
Stars
ASCII Nameouabagenin(1-)
DefinitionAn organic anion that is the conjugate base of ouabagenin resulting from the deprotonation of the furanone moiety; major species at pH 7.3.
Last Modified16 July 2020
SubmitterElisabeth Coudert
DownloadsMolfile
FormulaC23H33O8
Net Charge-1
Average Mass437.509
Monoisotopic Mass437.21809
SMILES[H][C@@]12CC[C@]3(O)C[C@@H](O)C[C@@H](O)[C@]3(CO)[C@@]1([H])[C@H](O)C[C@]1(C)[C@@H](c3[c-]oc(=O)c3)CC[C@]21O
InChIInChI=1S/C23H33O8/c1-20-9-16(26)19-15(23(20,30)5-3-14(20)12-6-18(28)31-10-12)2-4-21(29)8-13(25)7-17(27)22(19,21)11-24/h6,10,13-17,19,24-27,29-30H,2-5,7-9,11H2,1H3/q-1/t13-,14+,15+,16+,17+,19+,20+,21-,22+,23-/m0/s1
InChIKeyRPGXJNPPWHRVMA-QOHCMMFCSA-N
ChEBI Ontology
Outgoing Relation(s)
ouabagenin(1−) (CHEBI:145799) is a organic anion (CHEBI:25696)
ouabagenin(1−) (CHEBI:145799) is conjugate base of ouabagenin (CHEBI:71016)
Incoming Relation(s)
ouabagenin (CHEBI:71016) is conjugate acid of ouabagenin(1−) (CHEBI:145799)
IUPAC Name 
1β,3β,5,11α,14,19-hexahydroxy-17β-(5-oxo-2,5-dihydrofuran-2-id-3-yl)-5β,14β-androstane
Synonym  Source
ouabagenin anionChEBI
UniProt Name  Source
ouabageninUniProt
Citations