MiMeDB: Showing metabocard for N-Acetyl-D-muramoate (MMDBc0048044)

Record Information

Version

2.0

Status

Detected and Quantified

Creation Date

2022-04-29 21:46:50 UTC

Update Date

2025-01-16 11:08:05 UTC

Metabolite ID

MMDBc0048044

Metabolite Identification

Common Name

N-Acetyl-D-muramoate

Description

This compound belongs to the family of N-acyl-alpha-hexosamines. These are carbohydrate derivatives containing a hexose moeity in which the oxygen atom is replaced by an n-acyl group.

Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Molecular Formula

C₁₁H₁₉NO₈

Average Mass

293.2705

Monoisotopic Mass

293.111066589

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

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)/t4-,6-,7-,8-,9-,11?/m1/s1

InChI Key

MNLRQHMNZILYPY-MKFCKLDKSA-N

Chemical Taxonomy

Functional Ontology

Not Available

Physical Properties

State

Not Available

Predicted Properties

Not Available

Spectra

Not Available

Chromatographic Retention Times and Retention Indices

Retention Times

Chromatography Type	Technique	Column	Deposition Date	Retention Time (s)
Liquid Chromatography	HILIC	Waters Acquity UPLC-BEH Amide column (eluted)	2025-10-24	385.8
Liquid Chromatography	HILIC	Waters Acquity UPLC-BEH Amide column (eluted)	2025-10-24	385.8
Liquid Chromatography	HILIC	Accucore 150 Amide HILIC (eluted)	2025-10-24	278.3
Liquid Chromatography	HILIC	Accucore 150 Amide HILIC (eluted)	2025-10-24	278.3
Liquid Chromatography	Reversed-phase	Hypersil Gold 1.9 µm C18 (eluted)	2025-10-24	94.7
Liquid Chromatography	Reversed-phase	Hypersil Gold 1.9 µm C18 (eluted)	2025-10-24	94.7
Liquid Chromatography	Reversed-phase	Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) (eluted)	2025-10-24	256.1
Liquid Chromatography	Reversed-phase	Agilent Zorbax Eclipse Plus C18 (2.1 mm x 150 mm, 3.5 um) (eluted)	2025-10-24	256.1
Liquid Chromatography	Reversed-phase	XBridge C18 3.5u 2.1x50 mm (eluted)	2025-10-24	274.6
Liquid Chromatography	Reversed-phase	XBridge C18 3.5u 2.1x50 mm (eluted)	2025-10-24	274.6
Liquid Chromatography	Reversed-phase	Ascentis Express C18 (eluted)	2025-10-24	224.9
Liquid Chromatography	Reversed-phase	Ascentis Express C18 (eluted)	2025-10-24	224.9
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	791.1
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	791.1
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	589.3
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	589.3
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC (eluted)	2025-10-24	679.0
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC (eluted)	2025-10-24	679.0
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	143.9
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	143.9
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	249.7
Liquid Chromatography	HILIC	Merck SeQuant ZIC-HILIC (eluted)	2025-10-24	249.7
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	159.4
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC HSS T3 C18 (eluted)	2025-10-24	159.4
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	51.1
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	51.1
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	300.4
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	300.4
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	416.2
Liquid Chromatography	HILIC	Merck SeQuant ZIC-pHILIC column (eluted)	2025-10-24	416.2
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (void)	2025-10-24	54.1
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (void)	2025-10-24	54.1
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	206.0
Liquid Chromatography	Reversed-phase	Waters ACQUITY UPLC BEH C18 (eluted)	2025-10-24	206.0
Liquid Chromatography	Reversed-phase	Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex (eluted)	2025-10-24	867.8
Liquid Chromatography	Reversed-phase	Kinetex Core-Shell C18 2.6 um, 3.0 x 100 mm, Phenomenex (eluted)	2025-10-24	867.8
Liquid Chromatography	Reversed-phase	Waters Atlantis T3 (2.1 x 150 mm, 5 um) (eluted)	2025-10-24	581.8
Liquid Chromatography	Reversed-phase	Waters Atlantis T3 (2.1 x 150 mm, 5 um) (eluted)	2025-10-24	581.8

Retention Indices

Chromatography Type	Peak Label	SMILES	Stationary Phase	Deposition Date	Retention Index
Gas Chromatography	N-Acetyl-D-muramoate_TMS_1	CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	2283.85
Gas Chromatography	N-Acetyl-D-muramoate_TMS_2	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	2072.44
Gas Chromatography	N-Acetyl-D-muramoate_TMS_3	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	1097.55
Gas Chromatography	N-Acetyl-D-muramoate_TMS_4	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	2303.81
Gas Chromatography	N-Acetyl-D-muramoate_TMS_5	CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	2099.53
Gas Chromatography	N-Acetyl-D-muramoate_TMS_6	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	1955.45
Gas Chromatography	N-Acetyl-D-muramoate_TMS_7	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	1588.54
Gas Chromatography	N-Acetyl-D-muramoate_TMS_8	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	1916.15
Gas Chromatography	N-Acetyl-D-muramoate_TMS_9	CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	2042.06
Gas Chromatography	N-Acetyl-D-muramoate_TMS_10	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	2510.97
Gas Chromatography	N-Acetyl-D-muramoate_TMS_11	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	1955.12
Gas Chromatography	N-Acetyl-D-muramoate_TMS_12	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	1949.56
Gas Chromatography	N-Acetyl-D-muramoate_TMS_13	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	2491.31
Gas Chromatography	N-Acetyl-D-muramoate_TMS_14	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	1731.05
Gas Chromatography	N-Acetyl-D-muramoate_TMS_15	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	2176.38
Gas Chromatography	N-Acetyl-D-muramoate_TMS_16	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	2476.67
Gas Chromatography	N-Acetyl-D-muramoate_TMS_17	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	1916.93
Gas Chromatography	N-Acetyl-D-muramoate_TMS_18	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	2312.85
Gas Chromatography	N-Acetyl-D-muramoate_TMS_19	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard non polar	2025-10-24	1536.32
Gas Chromatography	N-Acetyl-D-muramoate_TMS_20	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	1783.37
Gas Chromatography	N-Acetyl-D-muramoate_TMS_21	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	1162.99
Gas Chromatography	N-Acetyl-D-muramoate_TMS_22	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	1698.8
Gas Chromatography	N-Acetyl-D-muramoate_TMS_23	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	1656.0
Gas Chromatography	N-Acetyl-D-muramoate_TMS_24	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	1846.57
Gas Chromatography	N-Acetyl-D-muramoate_TMS_25	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	2103.04
Gas Chromatography	N-Acetyl-D-muramoate_TMS_26	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard non polar	2025-10-24	2885.88
Gas Chromatography	N-Acetyl-D-muramoate_TMS_27	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	1243.28
Gas Chromatography	N-Acetyl-D-muramoate_TMS_28	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	1077.85
Gas Chromatography	N-Acetyl-D-muramoate_TMS_29	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard non polar	2025-10-24	3093.26
Gas Chromatography	N-Acetyl-D-muramoate_TMS_30	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	2130.98
Gas Chromatography	N-Acetyl-D-muramoate_TMS_31	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard non polar	2025-10-24	2692.07
Gas Chromatography	N-Acetyl-D-muramoate_TMS_1	CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	2292.06
Gas Chromatography	N-Acetyl-D-muramoate_TMS_2	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	2022.5
Gas Chromatography	N-Acetyl-D-muramoate_TMS_3	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	2135.65
Gas Chromatography	N-Acetyl-D-muramoate_TMS_4	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	1956.44
Gas Chromatography	N-Acetyl-D-muramoate_TMS_5	CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	2245.25
Gas Chromatography	N-Acetyl-D-muramoate_TMS_6	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	2936.02
Gas Chromatography	N-Acetyl-D-muramoate_TMS_7	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	2375.12
Gas Chromatography	N-Acetyl-D-muramoate_TMS_8	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	2506.18
Gas Chromatography	N-Acetyl-D-muramoate_TMS_9	CC(O)=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	2256.55
Gas Chromatography	N-Acetyl-D-muramoate_TMS_10	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	2277.32
Gas Chromatography	N-Acetyl-D-muramoate_TMS_11	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	1678.48
Gas Chromatography	N-Acetyl-D-muramoate_TMS_12	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	1654.98
Gas Chromatography	N-Acetyl-D-muramoate_TMS_13	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	1592.48
Gas Chromatography	N-Acetyl-D-muramoate_TMS_14	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	1651.29
Gas Chromatography	N-Acetyl-D-muramoate_TMS_15	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	2257.16
Gas Chromatography	N-Acetyl-D-muramoate_TMS_16	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	1473.17
Gas Chromatography	N-Acetyl-D-muramoate_TMS_17	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	1873.74
Gas Chromatography	N-Acetyl-D-muramoate_TMS_18	CC(=N[C@H]1C(O)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	2149.13
Gas Chromatography	N-Acetyl-D-muramoate_TMS_19	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O	standard polar	2025-10-24	2481.59
Gas Chromatography	N-Acetyl-D-muramoate_TMS_20	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	2010.62
Gas Chromatography	N-Acetyl-D-muramoate_TMS_21	CC(O)=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	1978.25
Gas Chromatography	N-Acetyl-D-muramoate_TMS_22	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	2615.29
Gas Chromatography	N-Acetyl-D-muramoate_TMS_23	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	2280.02
Gas Chromatography	N-Acetyl-D-muramoate_TMS_24	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	2270.32
Gas Chromatography	N-Acetyl-D-muramoate_TMS_25	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	1577.2
Gas Chromatography	N-Acetyl-D-muramoate_TMS_26	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O)O[Si](C)(C)C	standard polar	2025-10-24	2293.23
Gas Chromatography	N-Acetyl-D-muramoate_TMS_27	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	2241.18
Gas Chromatography	N-Acetyl-D-muramoate_TMS_28	CC(=N[C@H]1C(O)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	1607.18
Gas Chromatography	N-Acetyl-D-muramoate_TMS_29	CC(O)=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C	standard polar	2025-10-24	2899.39
Gas Chromatography	N-Acetyl-D-muramoate_TMS_30	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	1266.43
Gas Chromatography	N-Acetyl-D-muramoate_TMS_31	CC(=N[C@H]1C(O[Si](C)(C)C)O[C@H](CO[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[C@H](C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C	standard polar	2025-10-24	2258.08

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Feces

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species
MMDBp0193398	Peptidoglycan recognition protein 1	Enzyme	O75594	Homo sapiens
MMDBp0196033	Peptidoglycan recognition protein 3	Enzyme	Q96LB9	Homo sapiens
MMDBp0196034	Peptidoglycan recognition protein 4	Enzyme	Q96LB8	Homo sapiens
MMDBp0196922	N-acetylmuramoyl-L-alanine amidase	Unknown	Q96PD5

Human Pathways

Pathways

Name	SMPDB/PathBank

Microbial Pathways

Pathways

Not Available

Metabolic Reactions

Reactions

This table shows at most 20 reactions. For the full list of associated reactions:

See All Associated Reactions

Reaction ID	Precursor	Product	Enzyme	Reaction Type	Data Source	Reference

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Bacteria/Eubacteria	Firmicutes	53	Human feces; Human	Metabolic reconstruction
Bacteria/Eubacteria	Bacteroidetes	20	Human feces; Human ; Human gastric fluid; Human urine	Metabolic reconstruction
Bacteria/Eubacteria	Actinobacteria	2	Human feces; Human	Metabolic reconstruction
Bacteria	Firmicutes	1	Human feces; Human	Metabolic reconstruction
Bacteria/Eubacteria	Fusobacteria	1	Human feces	Metabolic reconstruction

Exposure Sources

Other Exposures

Source Type	Data Source	Reference

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference
Human Feces	Detected but not Quantified									HMDB

External Links

Not Available

General References

Magrane M: UniProt Knowledgebase: a hub of integrated protein data. Database (Oxford). 2011 Mar 29;2011:bar009. doi: 10.1093/database/bar009. Print 2011. [PubMed:21447597 ]

Showing metabocard for N-Acetyl-D-muramoate (MMDBc0048044)

MOL for #<Metabolite:0x00007f9ad85915d0>

3D MOL for #<Metabolite:0x00007f9ad85915d0>

3D SDF for #<Metabolite:0x00007f9ad85915d0>

3D-SDF for #<Metabolite:0x00007f9ad85915d0>

PDB for #<Metabolite:0x00007f9ad85915d0>

3D PDB for #<Metabolite:0x00007f9ad85915d0>

SMILES for #<Metabolite:0x00007f9ad85915d0>

INCHI for #<Metabolite:0x00007f9ad85915d0>

Structure for #<Metabolite:0x00007f9ad85915d0>

3D Structure for #<Metabolite:0x00007f9ad85915d0>