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CHEBI:157677 - prednisolone succinate(1−)

ChEBI IDCHEBI:157677
ChEBI Nameprednisolone succinate(1−)
Stars
ASCII Nameprednisolone succinate(1-)
DefinitionA dicarboxylic acid monoester(1−) that is the conjugate base of prednisolone succinate resulting from the deprotonation of the carboxy group. Major microspecies at pH 7.3.
Last Modified23 October 2020
SubmitterAdnan
DownloadsMolfile
FormulaC25H31O8
Net Charge-1
Average Mass459.515
Monoisotopic Mass459.20244
SMILES[H][C@@]12CC[C@](O)(C(=O)COC(=O)CCC(=O)[O-])[C@@]1(C)C[C@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChIInChI=1S/C25H32O8/c1-23-9-7-15(26)11-14(23)3-4-16-17-8-10-25(32,24(17,2)12-18(27)22(16)23)19(28)13-33-21(31)6-5-20(29)30/h7,9,11,16-18,22,27,32H,3-6,8,10,12-13H2,1-2H3,(H,29,30)/p-1/t16-,17-,18-,22+,23-,24-,25-/m0/s1
InChIKeyAPGDTXUMTIZLCJ-CGVGKPPMSA-M
ChEBI Ontology
Outgoing Relation(s)
prednisolone succinate(1−) (CHEBI:157677) is a dicarboxylic acid monoester(1−) (CHEBI:131605)
prednisolone succinate(1−) (CHEBI:157677) is conjugate base of prednisolone succinate (CHEBI:135745)
Incoming Relation(s)
prednisolone sodium succinate (CHEBI:32044) has part prednisolone succinate(1−) (CHEBI:157677)
prednisolone succinate (CHEBI:135745) is conjugate acid of prednisolone succinate(1−) (CHEBI:157677)
IUPAC Name 
4-[(11β,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy]-4-oxobutanoate
Synonyms  Source
prednisolone succinate anionChEBI
prednisolone hemisuccinate anionChEBI
prednisolone hemisuccinate(1−)ChEBI