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CHEBI:46276 - 3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acid

ChEBI IDCHEBI:46276
ChEBI Name3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acid
Stars
ASCII Name3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acid
Last Modified28 November 2014
DownloadsMolfile
FormulaC14H15N3O6S
Net Charge0
Average Mass353.356
Monoisotopic Mass353.06816
SMILES[H]OC(=O)c1sc([H])c([H])c1C([H])([H])n1c(=O)c(C([H])([H])[H])c([H])n(C([H])([H])[C@@]([H])(C(=O)O[H])N([H])[H])c1=O
InChIInChI=1S/C14H15N3O6S/c1-7-4-16(6-9(15)12(19)20)14(23)17(11(7)18)5-8-2-3-24-10(8)13(21)22/h2-4,9H,5-6,15H2,1H3,(H,19,20)(H,21,22)/t9-/m0/s1
InChIKeyZTAZUCRXCRXNSU-VIFPVBQESA-N
ChEBI Ontology
Outgoing Relation(s)
3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acid (CHEBI:46276) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acid (CHEBI:46276) is a pyrimidone (CHEBI:38337)
3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acid (CHEBI:46276) is a thiophenecarboxylic acid (CHEBI:48436)
Synonyms  Source
(S)-1-(2-AMINO-2-CARBOXYETHYL)-3(2-CARBOXYTHIOPHENE-3-YL-METHYL)-5-METHYLPYRIMIDINE-2,4-DIONEPDBeChem
3-({3-[(2S)-2-amino-2-carboxyethyl]-5-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl}methyl)thiophene-2-carboxylic acidPDBeChem
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