CHEBI:57567 - N6-(1,2-dicarboxylatoethyl)-AMP(4−)

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ChEBI Name N6-(1,2-dicarboxylatoethyl)-AMP(4−)
ChEBI ID CHEBI:57567
ChEBI ASCII Name N(6)-(1,2-dicarboxylatoethyl)-AMP(4-)
Definition Tetraanion of N6-(1,2-dicarboxyethyl)-AMP arising from deprotonation of carboxylic acid and phosphate functions.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:22262
Supplier Information No supplier information found for this compound.
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Formula C14H14N5O11P
Net Charge -4
Average Mass 459.26160
Monoisotopic Mass 459.04494
InChI InChI=1S/C14H18N5O11P/c20-7(21)1-5(14(24)25)18-11-8-12(16-3-15-11)19(4-17-8)13-10(23)9(22)6(30-13)2-29-31(26,27)28/h3-6,9-10,13,22-23H,1-2H2,(H,20,21)(H,24,25)(H,15,16,18)(H2,26,27,28)/p-4/t5?,6-,9-,10-,13-/m1/s1
InChIKey OFBHPPMPBOJXRT-DPXQIYNJSA-J
SMILES O[C@@H]1[C@@H](COP([O-])([O-])=O)O[C@H]([C@@H]1O)n1cnc2c(NC(CC([O-])=O)C([O-])=O)ncnc12
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing N6-(1,2-dicarboxylatoethyl)-AMP(4−) (CHEBI:57567) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
N6-(1,2-dicarboxylatoethyl)-AMP(4−) (CHEBI:57567) has role human metabolite (CHEBI:77746)
N6-(1,2-dicarboxylatoethyl)-AMP(4−) (CHEBI:57567) is a dicarboxylic acid dianion (CHEBI:28965)
N6-(1,2-dicarboxylatoethyl)-AMP(4−) (CHEBI:57567) is a organophosphate oxoanion (CHEBI:58945)
N6-(1,2-dicarboxylatoethyl)-AMP(4−) (CHEBI:57567) is conjugate base of N6-(1,2-dicarboxyethyl)-AMP (CHEBI:15919)
Incoming N6-(1,2-dicarboxyethyl)-AMP (CHEBI:15919) is conjugate acid of N6-(1,2-dicarboxylatoethyl)-AMP(4−) (CHEBI:57567)
IUPAC Name
N-(1,2-dicarboxylatoethyl)-5'-O-phosphonatoadenosine
Synonyms Sources
N6-(1,2-dicarboxyethyl)-AMP UniProt
N6-(1,2-dicarboxylatoethyl)-AMP tetraanion ChEBI
Last Modified
27 October 2017