CHEBI:137594 - N-acetyl-α-D-muramate 1-phosphate(3−)

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ChEBI Name N-acetyl-α-D-muramate 1-phosphate(3−)
ChEBI ID CHEBI:137594
ChEBI ASCII Name N-acetyl-alpha-D-muramate 1-phosphate(3-)
Definition An organophosphate oxoanion that is the trianion arising from deprotonation of the phosphate and carboxylic acid functions of N-acetyl-α-D-muramate 1-phosphate. Major microspecies at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anne Morgat
Supplier Information eMolecules:1360357, ZINC000000538471
Download Molfile XML SDF
Formula C11H17NO11P
Net Charge -3
Average Mass 370.227
Monoisotopic Mass 370.05557
InChI InChI=1S/C11H20NO11P/c1-4(10(16)17)21-9-7(12-5(2)14)11(23-24(18,19)20)22-6(3-13)8(9)15/h4,6-9,11,13,15H,3H2,1-2H3,(H,12,14)(H,16,17)(H2,18,19,20)/p-3/t4-,6-,7-,8-,9-,11-/m1/s1
InChIKey DTSXRQWOCZUNPL-YVNCZSHWSA-K
SMILES [C@@H]1(OP(=O)([O-])[O-])[C@H](NC(=O)C)[C@@H](O[C@@H](C([O-])=O)C)[C@@H]([C@H](O1)CO)O
ChEBI Ontology
Outgoing N-acetyl-α-D-muramate 1-phosphate(3−) (CHEBI:137594) has functional parent N-acetylmuramate (CHEBI:47978)
N-acetyl-α-D-muramate 1-phosphate(3−) (CHEBI:137594) is a carbohydrate acid derivative anion (CHEBI:63551)
N-acetyl-α-D-muramate 1-phosphate(3−) (CHEBI:137594) is a monocarboxylic acid anion (CHEBI:35757)
N-acetyl-α-D-muramate 1-phosphate(3−) (CHEBI:137594) is a organophosphate oxoanion (CHEBI:58945)
N-acetyl-α-D-muramate 1-phosphate(3−) (CHEBI:137594) is conjugate base of N-acetyl-α-D-muramic acid 1-phosphate (CHEBI:138229)
Incoming N-acetyl-α-D-muramic acid 1-phosphate (CHEBI:138229) is conjugate acid of N-acetyl-α-D-muramate 1-phosphate(3−) (CHEBI:137594)
IUPAC Name
2-acetamido-3-O-[(1R)-1-carboxylatoethyl]-2-deoxy-1-O-phosphonato-α-D-glucopyranose
Synonym Source
N-acetyl-α-D-muramate 1-phosphate UniProt
Manual Xref Database
CPD0-1643 MetaCyc
View more database links
Registry Number Type Source
11049317 Reaxys Registry Number Reaxys
Citation
Last Modified
17 August 2017