2-acetamido-3-O-[(1R)-1-carboxylatoethyl]-2-deoxy-D-glucopyranose (Q27103940)

N-acetyl-D-muramate (English)

5 October 2016

chemical formula

C₁₁H₁₈NO₈⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(C(=O)[O-])OC1C(C(OC(C1O)CO)O)NC(=O)C

1 reference

N-acetyl-D-muramate (English)

5 October 2016

isomeric SMILES

C[C@H](C(=O)[O-])O[C@H]1[C@@H]([C@H](OC([C@@H]1NC(=O)C)O)CO)O

1 reference

N-acetyl-D-muramate (English)

InChI=1S/C11H19NO8/c1-4(10(16)17)19-9-7(12-5(2)14)11(18)20-6(3-13)8(9)15/h4,6-9,11,13,15,18H,3H2,1-2H3,(H,12,14)(H,16,17)/p-1/t4-,6-,7-,8-,9-,11?/m1/s1

5 October 2016

Identifiers

InChI

1 reference

N-acetyl-D-muramate (English)

MNLRQHMNZILYPY-MKFCKLDKSA-M

5 October 2016

InChIKey

2 references

N-acetyl-D-muramate (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2-Acetamido-3-O-[(1R)-1-carboxylatoethyl]-2-deoxy-D-glucopyranose (English)

5 October 2016

2 references

N-acetyl-D-muramate (English)

matched by identifier from

5 October 2016

InChIKey

MNLRQHMNZILYPY-MKFCKLDKSA-M

ChEBI ID

28881

mapping relation type

2 references

2-acetamido-3-O-[(1R)-1-carboxylatoethyl]-2-deoxy-D-glucopyranose (English)