CHEBI:74622 - 15-oxo-β-bilirubin

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ChEBI Name 15-oxo-β-bilirubin ChEBI ID CHEBI:74622 ChEBI ASCII Name 15-oxo-beta-bilirubin Definition A biladiene that is the 15-oxo derivative of β-bilirubin. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C33H34N4O7 Net Charge 0 Average Mass 598.64570 Monoisotopic Mass 598.24275 InChI InChI=1S/C33H34N4O7/c1-7-19-16(4)29(34-24(19)13-23-15(3)20(8-2)33(44)36-23)31(42)30-17(5)21(9-11-27(38)39)25(35-30)14-26-22(10-12-28(40)41)18(6)32(43)37-26/h7-8,13-14,34-35H,1-2,9-12H2,3-6H3,(H,36,44)(H,37,43)(H,38,39)(H,40,41)/b23-13-,26-14- InChIKey ULCYRFMKALIVKM-BIBXUMTPSA-N SMILES CC1=C(CCC(O)=O)\C(NC1=O)=C\c1[nH]c(C(=O)c2[nH]c(\C=C3NC(=O)C(C=C)=C/3C)c(C=C)c2C)c(C)c1CCC(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 15-oxo-β-bilirubin (CHEBI:74622) is a biladienes (CHEBI:36735) 15-oxo-β-bilirubin (CHEBI:74622) is a dicarboxylic acid (CHEBI:35692) 15-oxo-β-bilirubin (CHEBI:74622) is conjugate acid of 15-oxo-β-bilirubin(2−) (CHEBI:74362) Incoming 15-oxo-β-bilirubin(2−) (CHEBI:74362) is conjugate base of 15-oxo-β-bilirubin (CHEBI:74622) Citation Type Source 20180905 PubMed citation Europe PMC Last Modified 09 July 2013