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CHEBI:17926 - hydrogenobyrinic acid
| Formula | C45H60N4O14 |
| Net Charge | 0 |
| Average Mass | 880.989 |
| Monoisotopic Mass | 880.41060 |
| SMILES | [H][C@]12N=C(/C(C)=C3\N=C(/C=C4\N=C(/C(C)=C5\N[C@]1(C)[C@@](C)(CC(=O)O)[C@@H]5CCC(=O)O)[C@@](C)(CC(=O)O)[C@@H]4CCC(=O)O)C(C)(C)[C@@H]3CCC(=O)O)[C@](C)(CCC(=O)O)[C@H]2CC(=O)O |
| InChI | InChI=1S/C45H60N4O14/c1-21-36-24(10-13-30(52)53)41(3,4)28(47-36)18-27-23(9-12-29(50)51)43(6,19-34(60)61)39(46-27)22(2)37-25(11-14-31(54)55)44(7,20-35(62)63)45(8,49-37)40-26(17-33(58)59)42(5,38(21)48-40)16-15-32(56)57/h18,23-26,40,49H,9-17,19-20H2,1-8H3,(H,50,51)(H,52,53)(H,54,55)(H,56,57)(H,58,59)(H,60,61)(H,62,63)/b27-18-,36-21-,37-22-/t23-,24-,25-,26+,40-,42-,43+,44+,45+/m1/s1 |
| InChIKey | MYMATQFDUQLSCD-IPUCCYEASA-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) |
| hydrogenobyrinic acid (CHEBI:17926) is a precorrin (CHEBI:26228) |
| hydrogenobyrinic acid (CHEBI:17926) is conjugate acid of hydrogenobyrinate(4−) (CHEBI:77873) |
| hydrogenobyrinic acid (CHEBI:17926) is conjugate acid of hydrogenobyrinate(6−) (CHEBI:58323) |
| Incoming Relation(s) |
| cob(II)yrinic acid (CHEBI:52499) has functional parent hydrogenobyrinic acid (CHEBI:17926) |
| cob(III)yrinic acid (CHEBI:33907) has functional parent hydrogenobyrinic acid (CHEBI:17926) |
| hydrogenobyrinic acid a,c-diamide (CHEBI:27914) has functional parent hydrogenobyrinic acid (CHEBI:17926) |
| cobyrinic acid (CHEBI:52500) is a hydrogenobyrinic acid (CHEBI:17926) |
| hydrogenobyrinate(4−) (CHEBI:77873) is conjugate base of hydrogenobyrinic acid (CHEBI:17926) |
| hydrogenobyrinate(6−) (CHEBI:58323) is conjugate base of hydrogenobyrinic acid (CHEBI:17926) |
| Synonyms | Source |
|---|---|
| Hydrogenobyrinate | KEGG COMPOUND |
| Hydrogenobyrinic acid | KEGG COMPOUND |
| Hydrogenobyrinsäure | ChEBI |
| Registry Numbers | Sources |
|---|---|
| Beilstein:4227766 | Beilstein |
| CAS:23599-55-5 | ChemIDplus |