CHEBI:133071 - N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate

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ChEBI Name N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate ChEBI ID CHEBI:133071 ChEBI ASCII Name N-[(9-beta-D-ribofuranosylpurin-6-yl)carbamoyl]threonate Definition A hydroxy monocarboxylic acid anion that is the conjugate base of N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonine, obtained by deprotonation of the carboxy group; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C15H19N6O8 Net Charge -1 Average Mass 411.347 Monoisotopic Mass 411.12699 InChI InChI=1S/C15H20N6O8/c1-5(23)7(14(26)27)19-15(28)20-11-8-12(17-3-16-11)21(4-18-8)13-10(25)9(24)6(2-22)29-13/h3-7,9-10,13,22-25H,2H2,1H3,(H,26,27)(H2,16,17,19,20,28)/p-1/t5-,6-,7+,9-,10-,13-/m1/s1 InChIKey UNUYMBPXEFMLNW-DWVDDHQFSA-M SMILES C1(=NC=NC=2N(C=NC12)[C@@H]3O[C@@H]([C@H]([C@H]3O)O)CO)NC(N[C@H](C([O-])=O)[C@@H](C)O)=O Metabolite of Species Details Escherichia coli (NCBI:txid562) See: PubMed Homo sapiens (NCBI:txid9606) See: PubMed Roles Classification Biological Role(s): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate (CHEBI:133071) has role Escherichia coli metabolite (CHEBI:76971) N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate (CHEBI:133071) has role human metabolite (CHEBI:77746) N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate (CHEBI:133071) is a hydroxy monocarboxylic acid anion (CHEBI:36059) N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate (CHEBI:133071) is conjugate base of N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonine (CHEBI:21440) Incoming N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonine (CHEBI:21440) is conjugate acid of N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]threonate (CHEBI:133071) IUPAC Name N-{[(1S,2R)-1-carboxylato-2-hydroxypropyl]carbamoyl}adenosine Synonyms Sources N-[(9-β-D-ribofuranosylpurin-6-yl)carbamoyl]-L-threonate ChEBI N6-carbamoyl-L-threonyladenosine(1−) ChEBI N6-carbamoylthreonyladenosine(1−) ChEBI N6-threonylcarbamoyladenosine(1−) ChEBI t6a(1−) ChEBI Last Modified 18 August 2016