MMN
Summary
| Name: | 5-DEOXY-5-{[(1S)-1-HYDROXYETHYL]AMINO}-D-GLUCITOL |
| Synonyms: | N-ACETYLMANNOSAMINITOL |
| Formula: | C8 H19 N O6 |
| Formal charge: | 0 |
| Formula weight: | 225.24 Da |
| Component type: | SACCHARIDE |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-deoxy-2-{[(1S)-1-hydroxyethyl]amino}-D-mannitol |
| OpenEye OEToolkits | 1.5.0 | (2R,3S,4R,5R)-5-(1-hydroxyethylamino)hexane-1,2,3,4,6-pentol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OC(C(NC(O)C)CO)C(O)C(O)CO |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](O)N[C@H](CO)[C@@H](O)[C@H](O)[C@H](O)CO |
| SMILES | CACTVS | 3.341 | C[CH](O)N[CH](CO)[CH](O)[CH](O)[CH](O)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(N[C@H](CO)[C@H]([C@@H]([C@@H](CO)O)O)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(NC(CO)C(C(C(CO)O)O)O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H19NO6/c1-4(12)9-5(2-10)7(14)8(15)6(13)3-11/h4-15H,2-3H2,1H3/t4-,5+,6+,7+,8+/m0/s1 |
| InChIKey | InChI | 1.03 | OUBSZQOZVSSBQR-SLBCVNJHSA-N |
