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CHEBI:16645 - preuroporphyrinogen
| Formula | C40H46N4O17 |
| Net Charge | 0 |
| Average Mass | 854.819 |
| Monoisotopic Mass | 854.28580 |
| SMILES | O=C(O)CCc1cnc(Cc2nc(Cc3nc(Cc4nc(CO)c(CC(=O)O)c4CCC(=O)O)c(CC(=O)O)c3CCC(=O)O)c(CC(=O)O)c2CCC(=O)O)c1CC(=O)O |
| InChI | InChI=1S/C40H46N4O17/c45-17-32-25(12-40(60)61)21(4-8-36(52)53)29(44-32)15-31-24(11-39(58)59)20(3-7-35(50)51)28(43-31)14-30-23(10-38(56)57)19(2-6-34(48)49)27(42-30)13-26-22(9-37(54)55)18(16-41-26)1-5-33(46)47/h16,41-45H,1-15,17H2,(H,46,47)(H,48,49)(H,50,51)(H,52,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61) |
| InChIKey | WDFJYRZCZIUBPR-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Escherichia coli (ncbitaxon:562) | - | PubMed (21988831) | |
| 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). Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| preuroporphyrinogen (CHEBI:16645) has role Escherichia coli metabolite (CHEBI:76971) |
| preuroporphyrinogen (CHEBI:16645) has role mouse metabolite (CHEBI:75771) |
| preuroporphyrinogen (CHEBI:16645) is a bilanes (CHEBI:22866) |
| preuroporphyrinogen (CHEBI:16645) is conjugate acid of preuroporphyrinogen(8−) (CHEBI:57845) |
| Incoming Relation(s) |
| preuroporphyrinogen(8−) (CHEBI:57845) is conjugate base of preuroporphyrinogen (CHEBI:16645) |
| IUPAC Name |
|---|
| 3,8,13,18-tetrakis(carboxymethyl)-19-(hydroxymethyl)bilane-2,7,12,17-tetrapropanoic acid |
| Synonyms | Source |
|---|---|
| Hydroxymethylbilane | KEGG COMPOUND |
| 3,8,13,18-tetrakis(carboxymethyl)-5,10,15,22,23,24-hexahydro-19-(hydroxymethyl)-21H-biline-2,7,12,17-tetrapropanoic acid | ChEBI |
| 3,8,13,18-tetrakis(carboxymethyl)-5,10,15,22,23,24-hexahydro-19-(hydroxymethyl)-21H-biline-2,7,12,17-tetrapropanoic acid | ChemIDplus |
| (hydroxymethyl)bilane | ChemIDplus |
| preuroporphyrinogen | ChemIDplus |
| Registry Numbers | Sources |
|---|---|
| Beilstein:1209089 | Beilstein |
| CAS:73023-76-4 | KEGG COMPOUND |
| CAS:71861-60-4 | ChemIDplus |
| CAS:71861-60-4 | KEGG COMPOUND |