CHEBI:58690 - 1,6-anhydro-N-acetyl-β-muramate

ChEBI IDCHEBI:58690
ChEBI Name1,6-anhydro-N-acetyl-β-muramate
Stars
ASCII Name1,6-anhydro-N-acetyl-beta-muramate
DefinitionA monocarboxylic acid anion obtained by removal of a proton from the carboxy group of 1,6-anhydro-N-acetyl-β-muramic acid.
Last Modified18 May 2023
DownloadsMolfile
FormulaC11H16NO7
Net Charge-1
Average Mass274.249
Monoisotopic Mass274.09323
SMILESCC(=O)N[C@H]1[C@@H]2OC[C@@H](O2)[C@@H](O)[C@@H]1O[C@H](C)C(=O)[O-]
InChIInChI=1S/C11H17NO7/c1-4(10(15)16)18-9-7(12-5(2)13)11-17-3-6(19-11)8(9)14/h4,6-9,11,14H,3H2,1-2H3,(H,12,13)(H,15,16)/p-1/t4-,6-,7-,8-,9-,11-/m1/s1
InChIKeyZFEGYUMHFZOYIY-YVNCZSHWSA-M
ChEBI Ontology
Outgoing Relation(s)
1,6-anhydro-N-acetyl-β-muramate (CHEBI:58690) is a carbohydrate acid derivative anion (CHEBI:63551)
1,6-anhydro-N-acetyl-β-muramate (CHEBI:58690) is a monocarboxylic acid anion (CHEBI:35757)
1,6-anhydro-N-acetyl-β-muramate (CHEBI:58690) is conjugate base of 1,6-anhydro-N-acetyl-β-muramic acid (CHEBI:40666)
Incoming Relation(s)
1,6-anhydro-N-acetyl-β-muramic acid (CHEBI:40666) is conjugate acid of 1,6-anhydro-N-acetyl-β-muramate (CHEBI:58690)
IUPAC Name 
(2R)-2-{[(1R,2S,3R,4R,5R)-4-acetamido-2-hydroxy-6,8-dioxabicyclo[3.2.1]oct-3-yl]oxy}propanoate
UniProt Name  Source
1,6-anhydro-N-acetyl-β-muramateUniProt
Manual XrefsDatabases
CPD0-882MetaCyc