CHEBI:71302 - MoO2-molybdopterin cofactor(2−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name MoO2-molybdopterin cofactor(2−)
ChEBI ID CHEBI:71302
ChEBI ASCII Name MoO2-molybdopterin cofactor(2-)
Definition An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of MoO2-molybdopterin cofactor.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
Download Molfile XML SDF
Formula C10H10MoN5O8PS2
Net Charge -2
Average Mass 519.26000
Monoisotopic Mass 520.876
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-4/t2-,3+,9-;;;/m1.../s1
InChIKey HDAJUGGARUFROU-JSUDGWJLSA-J
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
ChEBI Ontology
Outgoing MoO2-molybdopterin cofactor(2−) (CHEBI:71302) is a organophosphate oxoanion (CHEBI:58945)
MoO2-molybdopterin cofactor(2−) (CHEBI:71302) is conjugate base of MoO2-molybdopterin cofactor (CHEBI:71306)
Incoming MoO2-molybdopterin cofactor (CHEBI:71306) is conjugate acid of MoO2-molybdopterin cofactor(2−) (CHEBI:71302)
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(4−) phosphate}(dioxo)molybdate(2−)
Synonyms Sources
Mo-molybdopterin UniProt
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
26 August 2014