U9D
Summary
| Name: | 4-deoxy-2,3,6-tri-O-methyl-alpha-D-xylo-hexopyranose |
| Formula: | C9 H18 O5 |
| Formal charge: | 0 |
| Formula weight: | 206.236 Da |
| Component type: | D-saccharide, alpha linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 4-deoxy-2,3,6-tri-O-methyl-alpha-D-xylo-hexopyranose |
| OpenEye OEToolkits | 2.0.7 | (3~{R},4~{S},6~{S})-3,4-dimethoxy-6-(methoxymethyl)oxan-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C1C(OC(C(C1OC)OC)O)COC |
| InChI | InChI | 1.03 | InChI=1S/C9H18O5/c1-11-5-6-4-7(12-2)8(13-3)9(10)14-6/h6-10H,4-5H2,1-3H3/t6-,7-,8+,9?/m0/s1 |
| InChIKey | InChI | 1.03 | VGIKFUPOZBZSKX-VTBDLZGYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC[C@@H]1C[C@H](OC)[C@@H](OC)[C@@H](O)O1 |
| SMILES | CACTVS | 3.385 | COC[CH]1C[CH](OC)[CH](OC)[CH](O)O1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC[C@@H]1C[C@@H]([C@H](C(O1)O)OC)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | COCC1CC(C(C(O1)O)OC)OC |
