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CHEBI:177797 - Pentacarboxyl porphyrinogen III

ChEBI IDCHEBI:177797
ChEBI NamePentacarboxyl porphyrinogen III
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H40N4O10
Net Charge0
Average Mass700.745
Monoisotopic Mass700.27444
SMILESCC1=C(CCC(=O)O)C2=N/C1=C\c1nc(c(C)c1CCC(=O)O)CC1N=C(/C=c3\n/c(c(CC(=O)O)c3CCC(=O)O)=C\2)C(CCC(=O)O)=C1C
InChIInChI=1S/C37H40N4O10/c1-17-20(4-8-33(42)43)28-14-27-19(3)22(6-10-35(46)47)30(40-27)16-32-24(12-37(50)51)23(7-11-36(48)49)31(41-32)15-29-21(5-9-34(44)45)18(2)26(39-29)13-25(17)38-28/h14-16,26,38,41H,4-13H2,1-3H3,(H,42,43)(H,44,45)(H,46,47)(H,48,49)(H,50,51)/b27-14-,31-15-,32-16-
InChIKeyQDDLLFZOMVJQEQ-XJTMSCLRSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
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)
Pentacarboxyl porphyrinogen III (CHEBI:177797) is a porphyrins (CHEBI:26214)
IUPAC Name 
3-[(10Z,15Z,19Z)-8,13,18-tris(2-carboxyethyl)-17-(carboxymethyl)-3,7,12-trimethyl-4,5,22,24-tetrahydroporphyrin-2-yl]propanoic acid
Manual XrefsDatabases
13628281ChemSpider
HMDB0001957HMDB