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CHEBI:36163 - ferroheme a
| Formula | C49H56FeN4O6 |
| Net Charge | 0 |
| Average Mass | 852.854 |
| Monoisotopic Mass | 852.35492 |
| SMILES | [H]C(=O)C1=C(CCC(=O)O)C2=[N]3C1=Cc1c(C)c([C@@H](O)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)c4[n]1[Fe]31[N]3=C(C=c5c(C)c(CCC(=O)O)c([n]51)=C2)C(C=C)=C(C)C3=C4 |
| InChI | InChI=1S/C49H58N4O6.Fe/c1-9-34-31(6)39-25-45-49(46(55)18-12-17-30(5)16-11-15-29(4)14-10-13-28(2)3)33(8)40(52-45)24-44-37(27-54)36(20-22-48(58)59)43(53-44)26-42-35(19-21-47(56)57)32(7)38(51-42)23-41(34)50-39;/h9,13,15,17,23-27,46,55H,1,10-12,14,16,18-22H2,2-8H3,(H4,50,51,52,53,54,56,57,58,59);/q;+2/p-2/b29-15+,30-17+,38-23-,39-25-,40-24-,41-23-,42-26-,43-26-,44-24-,45-25-;/t46-;/m0./s1 |
| InChIKey | ZGGYGTCPXNDTRV-PRYGPKJJSA-L |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| Roles Classification |
|---|
| Biological Roles: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. prosthetic group A tightly bound, specific nonpolypeptide unit in a protein determining and involved in its biological activity. 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). 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). metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. prosthetic group A tightly bound, specific nonpolypeptide unit in a protein determining and involved in its biological activity. 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). 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) |
| ferroheme a (CHEBI:36163) has role mouse metabolite (CHEBI:75771) |
| ferroheme a (CHEBI:36163) is a ferroheme (CHEBI:38573) |
| ferroheme a (CHEBI:36163) is a heme a (CHEBI:24479) |
| ferroheme a (CHEBI:36163) is conjugate acid of ferroheme a(2−) (CHEBI:61715) |
| Incoming Relation(s) |
| ferroheme a(2−) (CHEBI:61715) is conjugate base of ferroheme a (CHEBI:36163) |
| IUPAC Name |
|---|
| [3,3'-{7-ethenyl-17-formyl-12-[(1S,4E,8E)-1-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-yl]-3,8,13-trimethylporphyrin-2,18-diyl-κ4N21,N22,N23,N24}dipropanoato(2−)]iron |
| Synonyms | Source |
|---|---|
| (cytoporphyrinato)iron(II) | ChEBI |
| {3,3'-[7-ethenyl-17-formyl-12-(1-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-yl)-3,8,13-trimethylporphyrin-2,18-diyl-κ4N21,N22,N23,N24]dipropanoato(2−)}iron | IUPAC |