Basic information
- CAS
14131-64-7- Standard SMILES
CC(=O)N[C@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O- InChIKey
OVRNDRQMDRJTHS-UOLFYFMNSA-N- Molecular formula
- C8H15NO6
- Average molar mass
- 221.21 g/mol
- Monoisotopic mass
- 221.0899372
Overview
N-acetyl-alpha-D-mannosamine is an N-acetylmannosamine having pyranose form and alpha-D-configuration.
Names & identifiers
- Preferred name
- alpha-D-N-Acetylmannosamine
- IUPAC
- N-[(2S,3S,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
- English name
- N-Acetyl-D-mannosamine monohydrate
- Molecular formula
- C8H15NO6
- Molecular weight
- 221.21
Names & synonyms
14131-64-72-(ACETYLAMINO)-2-DEOXY-ALPHA-D-MANNOPYRANOSEA1O5EUP7KSalpha-D-N-AcetylmannosamineGlyTouCan:G74060NYMannopyranose, 2-acetamido-2-deoxy-, alpha-D-RefChem:936478G74060NYalpha-ManAcN-acetyl-alpha-D-mannosaminealpha-D-ManpAcalpha-D-ManAc
Show more names
N-ACETYL-D-MANNOSAMINE HYDRATEN-ACETYL-D-MANNOSAMINE 1-HYDRATEN-Acetyl-D-mannosamine monohydrateα-D-Mannopyranose, 2-(acetylamino)-2-deoxy-2-ACETAMIDO-2-DEOXY-D-MANNOPYRANOSE HYDRATE
N-[(2S,3S,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide2-acetamido-2-deoxy-alpha-D-mannopyranoseCHEBI:411122-acetamido-2-deoxy-alpha-D-mannose2-acetylamino-alpha-D-2-deoxy-mannopyranosealpha-D-Mannopyranose, 2-(acetylamino)-2-deoxy-UNII-A1O5EUP7KS2yhw
Database identifiers
- CAS
14131-64-7- PubChem CID
- 644170
- ChEMBL
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Physicochemical properties
- Melting point
- 130 C · 130 C
- Boiling point
- 595.4 · 595.4±50.0 °C(Predicted)
- Density
- 1.5 · 1.50±0.1 g/cm3(Predicted)
- pka
- 12.04 · 12.04±0.70(Predicted)
- FDA UNII
- 1 O5EUP7KS · A1O5EUP7KS
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- HS Code
- 29329985 · 29329985
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 29329985
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
Chemistry & industry
Suppliers4 total
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
济南山目生物医药科技有限公司0531-88821801 15192360884 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
泰兴市海川生物科技有限公司19353112242 · [email protected]
Additional notes
DefinitionChEBI: N-acetyl-alpha-D-mannosamine is an N-acetylmannosamine having pyranose form and alpha-D-configuration.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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