A1A0O
Summary
| Name: | 1-deoxy-1-(morpholin-4-yl)-D-fructose |
| Synonyms: | 1-Deoxy-1-morpholino-D-fructose |
| Formula: | C10 H19 N O6 |
| Formal charge: | 0 |
| Formula weight: | 249.261 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-deoxy-1-(morpholin-4-yl)-D-fructose |
| OpenEye OEToolkits | 2.0.7 | (3~{S},4~{R},5~{R})-1-morpholin-4-yl-3,4,5,6-tetrakis(oxidanyl)hexan-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(CN1CCOCC1)C(O)C(O)C(O)CO |
| InChI | InChI | 1.06 | InChI=1S/C10H19NO6/c12-6-8(14)10(16)9(15)7(13)5-11-1-3-17-4-2-11/h8-10,12,14-16H,1-6H2/t8-,9-,10-/m1/s1 |
| InChIKey | InChI | 1.06 | JPANQHVKLYKLEB-OPRDCNLKSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC[C@@H](O)[C@@H](O)[C@H](O)C(=O)CN1CCOCC1 |
| SMILES | CACTVS | 3.385 | OC[CH](O)[CH](O)[CH](O)C(=O)CN1CCOCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1COCCN1CC(=O)[C@H]([C@@H]([C@@H](CO)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1COCCN1CC(=O)C(C(C(CO)O)O)O |
