EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:131725 - coproporphyrin III(4−)

ChEBI IDCHEBI:131725
ChEBI Namecoproporphyrin III(4−)
Stars
ASCII Namecoproporphyrin III(4-)
DefinitionA cyclic tetrapyrrole anion obtained by deprotonation of the four carboxy groups of coproporphyrin III; major species at pH 7.3.
Last Modified27 May 2016
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC36H34N4O8
Net Charge-4
Average Mass650.688
Monoisotopic Mass650.23986
SMILESCC1=C(CCC(=O)[O-])c2cc3nc(cc4nc(cc5nc(cc1n2)c(CCC(=O)[O-])c5C)C(C)=C4CCC(=O)[O-])c(CCC(=O)[O-])c3C
InChIInChI=1S/C36H38N4O8/c1-17-21(5-9-33(41)42)29-14-27-19(3)22(6-10-34(43)44)30(39-27)15-28-20(4)24(8-12-36(47)48)32(40-28)16-31-23(7-11-35(45)46)18(2)26(38-31)13-25(17)37-29/h13-16,37,40H,5-12H2,1-4H3,(H,41,42)(H,43,44)(H,45,46)(H,47,48)/p-4/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
InChIKeyJWFCYWSMNRLXLX-UJJXFSCMSA-J
ChEBI Ontology
Outgoing Relation(s)
coproporphyrin III(4−) (CHEBI:131725) is a cyclic tetrapyrrole anion (CHEBI:58941)
coproporphyrin III(4−) (CHEBI:131725) is conjugate base of coproporphyrin III (CHEBI:27609)
Incoming Relation(s)
coproporphyrin III (CHEBI:27609) is conjugate acid of coproporphyrin III(4−) (CHEBI:131725)
IUPAC Name 
3,3',3'',3'''-(3,8,13,17-tetramethylporphyrin-2,7,12,18-tetrayl)tetrapropanoate
UniProt Name  Source
coproporphyrin IIIUniProt
Manual XrefsDatabases
COPROPORPHYRIN_IIIMetaCyc