1,5-anhydro-D-mannitol
Basic information
- CAS
492-93-3- Standard SMILES
OC[C@H]1OC[C@@H](O)[C@@H](O)[C@@H]1O- InChIKey
MPCAJMNYNOGXPB-KVTDHHQDSA-N- Molecular formula
- C6H12O5
- Average molar mass
- 164.16 g/mol
- Monoisotopic mass
- 164.06847348
Overview
1,5-anhydro-D-mannitol is an anhydro sugar. It is functionally related to a D-mannitol.
Names & identifiers
- Preferred name
- 1,5-anhydro-D-mannitol
- IUPAC
- (2R,3S,4R,5R)-2-(hydroxymethyl)oxane-3,4,5-triol
- English name
- 1-5-Anhydro-D-mannitol crystalline
- Molecular formula
- C6H12O5
- Molecular weight
- 164.16
Names & synonyms
1,5-Anhydro-d-mannitol492-93-3Styracitol1,5-Anhydromannitol1,5-Anhydro-mannitol(2R,3S,4R,5R)-2-(hydroxymethyl)oxane-3,4,5-triolD-Mannitol, 1,5-anhydro-6V415COZ8ICHEBI:49182DTXSID701314215RefChem:73426GlyTouCan:G04988XL
Show more names
1,5-Anhydrohexitol1,5-Anhydro-D-mannitol, Min. 98%1,5-Anhydro-D-mannitol - [A94590]1-5-Anhydro-D-mannitol crystalline
DTXCID701744026G04988XLStyracit(2R,3S,4R,5R)-2-(Hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol2,6-Anhydro-D-mannitol1-deoxy-alpha-D-mannopyranoseStyractitolUNII-6V415COZ8I
Database identifiers
- CAS
492-93-3- PubChem CID
- 445184
- DTXSID
DTXSID701314215- ChEMBL
CHEMBL3800290- ChEBI
CHEBI:49182- UNII
- 6V415COZ8I
- Nikkaji
- J12.575J
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 90.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 128
Physicochemical properties
- Melting point
- 156 · 156-157C
- Boiling point
- 376.8 · 376.8±42.0 °C(Predicted)
- Density
- 1.533 · 1.533±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer, Under Inert Atmosphere
- solubility
- Methanol (Slightly, Heated), Water (Slightly)
- form
- crystals
- pka
- 13.44 · 13.44±0.70(Predicted)
- color
- White
- FDA UNII
- 6 V415COZ8I · 6V415COZ8I
- HS Code
- 29400090 · 29400090
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
- 29400090
Chemistry & industry
Applications
UsesA carbohydrate metabolism regulator that has been shown to inhibit gluconeogenesis from lactate plus pyruvate and from substrates that enter the gluconeogenic pathway as triose phosphate.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: 1,5-anhydro-D-mannitol is an anhydro sugar. It is functionally related to a D-mannitol.
Suppliers
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Related reactions
1 records
Compound notes
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