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CHEBI:133626 - mesoporphyrin IX

ChEBI IDCHEBI:133626
ChEBI Namemesoporphyrin IX
Stars
DefinitionA member of the class of mesoporphyrins obtained by formal hydrogenation of the two vinyl groups in protoporphyrin.
Last Modified15 February 2017
SubmitterMargaret Duesbury
DownloadsMolfile
FormulaC34H38N4O4
Net Charge0
Average Mass566.702
Monoisotopic Mass566.28931
SMILESCCC1=C(C)c2cc3nc(cc4nc(cc5nc(cc1n2)c(C)c5CCC(=O)O)C(CCC(=O)O)=C4C)c(C)c3CC
InChIInChI=1S/C34H38N4O4/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25/h13-16,35,38H,7-12H2,1-6H3,(H,39,40)(H,41,42)/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-
InChIKeyUQVVDGKMSUMXBI-UJJXFSCMSA-N
Roles Classification
Biological Role:
cofactor  An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
ChEBI Ontology
Outgoing Relation(s)
mesoporphyrin IX (CHEBI:133626) is a mesoporphyrins (CHEBI:59559)
IUPAC Name 
3,3'-(7,12-diethyl-3,8,13,17-tetramethylporphyrin-2,18-diyl)dipropanoic acid
Synonyms  Source
7,12-Diethyl-3,8,13,17-tetramethyl-2,18-porphinedipropionic acidHMDB
7,12-Diethyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropanoic acidHMDB
MPIXHMDB
Manual XrefsDatabases
HMDB0002379HMDB
Registry NumbersSources
Reaxys:381064Reaxys
Reaxys:601056Reaxys
CAS:493-90-3ChemIDplus
Citations