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CHEBI:85276 - (3E)-phycoerythrobilin(2−)

ChEBI IDCHEBI:85276
ChEBI Name(3E)-phycoerythrobilin(2−)
Stars
ASCII Name(3E)-phycoerythrobilin(2-)
DefinitionA dicarboxylic acid dianion obtained by deprotonation of the carboxy groups of (3E)-phycoerythrobilin; major species at pH 7.3.
Last Modified3 August 2020
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC33H36N4O6
Net Charge-2
Average Mass584.673
Monoisotopic Mass584.26458
SMILES[H][C@]1(Cc2nc(/C=C3\N=C(/C=C4\NC(=O)[C@H](C)\C4=C/C)C(C)=C3CCC(=O)[O-])c(CCC(=O)[O-])c2C)NC(=O)C(C=C)=C1C
InChIInChI=1S/C33H38N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,14-15,19,26,34H,2,9-13H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/p-2/b20-7+,27-14-,29-15-/t19-,26-/m1/s1
InChIKeyCNEWLWMGPFUJPG-JCEXRVCVSA-L
ChEBI Ontology
Outgoing Relation(s)
(3E)-phycoerythrobilin(2−) (CHEBI:85276) is a dicarboxylic acid dianion (CHEBI:28965)
(3E)-phycoerythrobilin(2−) (CHEBI:85276) is a linear tetrapyrrole anion (CHEBI:59252)
(3E)-phycoerythrobilin(2−) (CHEBI:85276) is conjugate base of (3E)-phycoerythrobilin (CHEBI:85659)
Incoming Relation(s)
(3E)-phycoerythrobilin (CHEBI:85659) is conjugate acid of (3E)-phycoerythrobilin(2−) (CHEBI:85276)
UniProt Name  Source
(2R,3E)-phycoerythrobilinUniProt
Manual XrefsDatabases
CPD-17223MetaCyc
Citations