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CHEBI:85659 - (3E)-phycoerythrobilin

ChEBI IDCHEBI:85659
ChEBI Name(3E)-phycoerythrobilin
Stars
ASCII Name(3E)-phycoerythrobilin
DefinitionThe (3E)-isomer of phycoerythrobilin.
Last Modified6 May 2015
SubmitterSteve
DownloadsMolfile
FormulaC33H38N4O6
Net Charge0
Average Mass586.689
Monoisotopic Mass586.27913
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)/b20-7+,27-14-,29-15-/t19-,26-/m1/s1
InChIKeyCNEWLWMGPFUJPG-JCEXRVCVSA-N
ChEBI Ontology
Outgoing Relation(s)
(3E)-phycoerythrobilin (CHEBI:85659) is a phycoerythrobilin (CHEBI:36741)
(3E)-phycoerythrobilin (CHEBI:85659) is conjugate acid of (3E)-phycoerythrobilin(2−) (CHEBI:85276)
Incoming Relation(s)
(3E)-phycoerythrobilin(2−) (CHEBI:85276) is conjugate base of (3E)-phycoerythrobilin (CHEBI:85659)
Synonym  Source
PhycoerythrobilinChemIDplus
Manual XrefsDatabases
CPD-17223MetaCyc
Registry NumbersSources
CAS:18097-67-1ChemIDplus