HuagongsheHuagongshe Chemistry Print Report · For research reference only
GlyTouCan:G09597LJ
Alt · d-[UL-13C6]altrose · (2S,3R,4R,5R)-2,3,4,5,6-Pentahydroxyhexanal · altrose · D-ALTROSE · B-D-Altrose · ALTROSE, D- · α-D-Altrose
Identifiers & Physical Properties
| CAS No. | 1990-29-0 |
|---|---|
| Molecular formula | C6H12O6 |
| Average molar mass | 180.16 g/mol |
| Monoisotopic mass | 180.0633881 g/mol |
| SMILES | O=CC(O)C(O)C(O)C(O)CO |
| InChIKey | GZCGUPFRVQAUEE-UHFFFAOYSA-N |
| PubChem CID | 24749 |
| ChEMBL | CHEMBL1206211 |
| ChEBI | CHEBI:33917 |
| EC No. | 222-392-4 |
| DTXSID | DTXSID70860057 |
Chemical & Physical Properties
| XLogP | -2.9 |
|---|---|
| Topological polar surface area | 118 |
| Hydrogen bond donors | 5 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 5 |
| Heavy atoms | 12 |
| Formal charge | 0 |
| Complexity | 138 |
| Chemical classes | Biological Agents -> Monosaccharides and Derivatives |
| Drugs | Pharmaceuticals |
| Vapor pressure | 0.00000002 [mmHg] |
| Physical Description | White hygroscopic powder[Alfa Aesar MSDS] |
| Melting point | 106-108 °C |
| alpha | D20 +32.6° (c = 7.6) |
| Boiling point | 232.96°C (rough estimate) |
| Density | 1.581 |
| Refractive index | 1.5860 (estimate) |
| Storage conditions | 2-8°C |
| Solubility | DMSO (Slightly), Methanol (Slightly, Heated), Water (Slightly) |
| Physical state | Powder |
| pKa (acidity coefficient) | 12.45±0.20(Predicted) |
| Color | White to off-white |
| optical activity | [α]/D 33.0±2.0°, c = 0.2 in H2O |
| Merck | 13,319 |
| BRN | 1724621 |
| InChI | 1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2 |
| InChIKey | GZCGUPFRVQAUEE-UHFFFAOYSA-N |
| SMILES | OC[C@H]1OC(O)[C@@H](O)[C@H](O)[C@@H]1O |
| LogP (partition coefficient) | -3.290 (est) |
| CAS DataBase Reference | 1990-29-0(CAS DataBase Reference) |
| FDA UNII | 5PLN1O36FF |
| UNSPSC Code | 12352201 |
| NACRES | NA.25 |
| Personal protective equipment (PPE) | Eyeshields, Gloves, type N95 (US) |
| Hazard symbols | Xi |
| Risk statements (R) | 36/37/38 |
| Safety statements (S) | 24/25-36-26 |
| Water hazard class (WGK) | 3 |
| Customs code | 29400090 |
| Storage class | 11 - Combustible Solids |
Safety & Regulations
| GHS classification | This chemical does not meet GHS hazard criteria for 99.4% (158 of 159) of all reports.Not ClassifiedAggregated GHS information provided per 159 reports by companies from 3 notifications to the ECHA C&L Inventory. |
|---|---|
| Regulatory information | Chemical: D-MannoseChemical: Liquid glucoseStatus: Active Update: 15-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/23819D-Mannose: Does not have an individual approval but may be used under an appropriate group standardLiquid glucose: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
| Other safety information | IMAP assessments - D-Mannose: Human health tier I assessmentIMAP assessments - Liquid glucose: Human health tier I assessment |
| Hazards summary | May cause irritation[Alfa Aesar MSDS] |
| Hazard Classes and Categories | Not Classified |
| Personal protective equipment (PPE) | Eyeshields, Gloves, type N95 (US) |
| Water hazard class (WGK) | 3 |
| Customs code | 29400090 |
| Risk statements (R) | 36/37/38 |
| Hazard symbols | Xi |
| Safety statements (S) | 24/25-36-26 |
| Storage class | 11 - Combustible Solids |
Applications & Uses
Uses
D-Altrose is the epimer of D-glucose at C3 and have recently been discovered to possess antioxidant properties by the suppression of reactive oxygen species production in mitochondria due to competiti on with D-glucose at the cellular level.