CHEBI:60538 - Mo(V)-molybdopterin cytosine dinucleotide(2−)

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ChEBI Name Mo(V)-molybdopterin cytosine dinucleotide(2−)
ChEBI ID CHEBI:60538
ChEBI ASCII Name Mo(V)-molybdopterin cytosine dinucleotide(2-)
Definition An organophosphate oxoanion arising from deprotonation of the two diphosphate OH groups of Mo(V)-molybdopterin cytosine dinucleotide; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C19H25MoN8O16P2S2
Net Charge -2
Average Mass 843.46000
Monoisotopic Mass 844.93702
InChI InChI=1S/C19H26N8O13P2S2.Mo.3H2O/c20-7-1-2-27(19(31)22-7)17-11(29)10(28)5(39-17)3-36-41(32,33)40-42(34,35)37-4-6-12(43)13(44)8-16(38-6)24-14-9(23-8)15(30)26-18(21)25-14;;;;/h1-2,5-6,8,10-11,16-17,23,28-29,43-44H,3-4H2,(H,32,33)(H,34,35)(H2,20,22,31)(H4,21,24,25,26,30);;3*1H2/q;+5;;;/p-7/t5-,6-,8+,10-,11-,16-,17-;;;;/m1..../s1
InChIKey GISCHECZIOGHRK-MQPNXHJTSA-G
SMILES [H][C@]12Nc3nc(N)[nH]c(=O)c3N[C@@]1([H])C1=C(S[Mo](O)(O)(O)S1)[C@@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(N)nc1=O)O2
ChEBI Ontology
Outgoing Mo(V)-molybdopterin cytosine dinucleotide(2−) (CHEBI:60538) is a organophosphate oxoanion (CHEBI:58945)
Mo(V)-molybdopterin cytosine dinucleotide(2−) (CHEBI:60538) is conjugate base of Mo(V)-molybdopterin cytosine dinucleotide (CHEBI:61127)
Incoming Mo(V)-molybdopterin cytosine dinucleotide (CHEBI:61127) is conjugate acid of Mo(V)-molybdopterin cytosine dinucleotide(2−) (CHEBI:60538)
Synonyms Sources
Mo(V)-molybdopterin cytosine dinucleotide UniProt
Mo(V)-molybdopterin cytosine dinucleotide dianion ChEBI
Last Modified
30 November 2012