MRH
Summary
Name: | 4-acetamido-4,6-dideoxy-alpha-D-mannopyranose |
Synonyms: | alpha-N-Acetylperosamine 4-acetamido-4,6-dideoxy-alpha-D-mannose; 4-acetamido-4,6-dideoxy-D-mannose; 4-acetamido-4,6-dideoxy-mannose |
Formula: | C8 H15 N O5 |
Formal charge: | 0 |
Formula weight: | 205.208 Da |
Component type: | D-saccharide, alpha linking |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-[(2~{R},3~{S},4~{S},5~{S},6~{S})-2-methyl-4,5,6-tris(oxidanyl)oxan-3-yl]ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H15NO5/c1-3-5(9-4(2)10)6(11)7(12)8(13)14-3/h3,5-8,11-13H,1-2H3,(H,9,10)/t3-,5-,6+,7+,8+/m1/s1 |
InChIKey | InChI | 1.03 | LMIZXKMXHCOVTQ-PCRKCNGPSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1NC(C)=O |
SMILES | CACTVS | 3.385 | C[CH]1O[CH](O)[CH](O)[CH](O)[CH]1NC(C)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)NC(=O)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1C(C(C(C(O1)O)O)O)NC(=O)C |