CHEBI:71306 - MoO2-molybdopterin cofactor

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ChEBI Name MoO2-molybdopterin cofactor
ChEBI ID CHEBI:71306
ChEBI ASCII Name MoO2-molybdopterin cofactor
Definition An Mo-molybdopterin cofactor in which the coordinated molybdenum species is MoO2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C10H12MoN5O8PS2
Net Charge 0
Average Mass 521.27000
Monoisotopic Mass 522.89190
InChI InChI=1S/C10H14N5O6PS2.Mo.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);;;/q;+2;;/p-2/t2-,3+,9-;;;/m1.../s1
InChIKey HDAJUGGARUFROU-JSUDGWJLSA-L
SMILES [H][C@]12Nc3nc(N)[nH]c(=O)c3N[C@@]1([H])C1=C(S[Mo](=O)(=O)S1)[C@@H](COP(O)(O)=O)O2
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via Mo-molybdopterin cofactor )
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).
(via molybdopterin cofactor )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing MoO2-molybdopterin cofactor (CHEBI:71306) is a Mo-molybdopterin cofactor (CHEBI:21437)
MoO2-molybdopterin cofactor (CHEBI:71306) is conjugate acid of MoO2-molybdopterin cofactor(2−) (CHEBI:71302)
Incoming Mo(=O)(=S)-molybdopterin cofactor (CHEBI:83233) has functional parent MoO2-molybdopterin cofactor (CHEBI:71306)
MoO2-molybdopterin cofactor(2−) (CHEBI:71302) is conjugate base of MoO2-molybdopterin cofactor (CHEBI:71306)
IUPAC Name
{[(5aR,8R,9aR)-2-amino-4-oxo-6,7-di(sulfanyl-κS)-3,5,5a,8,9a,10-hexahydro-4H-pyrano[3,2-g]pteridin-8-yl]methyl dihydrogenato(2−) phosphate}(dioxo)molybdenum
Synonyms Sources
MoCo (dioxyo) MetaCyc
molybdenum cofactor MetaCyc
molybdenum cofactor (dioxyo) MetaCyc
MoO2(OH)Dtpp-mP MetaCyc
Manual Xref Database
CPD-8123 MetaCyc
View more database links
Last Modified
03 October 2014