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CHEBI:71306 - Mo(VI)O2(OH)-molybdopterin cofactor
| Formula | C10H13MoN5O9PS2 |
| Net Charge | -1 |
| Average Mass | 538.288 |
| Monoisotopic Mass | 539.89519 |
| SMILES | [H][C@@]12Nc3c(nc(N)nc3=O)N[C@]1([H])O[C@H](COP(=O)(O)O)C1=C2[S][Mo-](=[O])(=[O])([OH])[S]1 |
| InChI | InChI=1S/C10H14N5O6PS2.Mo.H2O.2O/c11-10-14-7-4(8(16)15-10)12-3-6(24)5(23)2(21-9(3)13-7)1-20-22(17,18)19;;;;/h2-3,9,12,23-24H,1H2,(H2,17,18,19)(H4,11,13,14,15,16);;1H2;;/q;+2;;;/p-3/t2-,3+,9-;;;;/m1..../s1 |
| InChIKey | ODSJFVQKGDHXNB-BKZHXLINSA-K |
| Roles Classification |
|---|
| Biological Roles: | Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. 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) |
| Mo(VI)O2(OH)-molybdopterin cofactor (CHEBI:71306) is a Mo-molybdopterin cofactor (CHEBI:21437) |
| Mo(VI)O2(OH)-molybdopterin cofactor (CHEBI:71306) is conjugate acid of Mo(VI)O2(OH)-molybdopterin cofactor(4−) (CHEBI:71302) |
| Incoming Relation(s) |
| Mo(VI)(=O)(=S)(OH)-molybdopterin cofactor (CHEBI:83233) has functional parent Mo(VI)O2(OH)-molybdopterin cofactor (CHEBI:71306) |
| Mo(VI)O2(OH)-molybdopterin cofactor(4−) (CHEBI:71302) is conjugate base of Mo(VI)O2(OH)-molybdopterin cofactor (CHEBI:71306) |
| IUPAC Name |
|---|
| {[(5aR,8R,9aR)-2-amino-4-oxo-6,7-bis(sulfanyl-κS)-3,5,5a,8,9a,10-hexahydro-4H-pyrano[3,2-g]pteridin-8-yl]methyl dihydrogenato(2−) phosphate}(hydroxy)bis(oxido)molybdate(1−) |
| Synonyms | Source |
|---|---|
| molybdenum cofactor | MetaCyc |
| MoO2(OH)Dtpp-mP | MetaCyc |
| MoO2(OH)-molybdopterin cofactor | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| CPD-8123 | MetaCyc |
| Citations |
|---|