RVG
Summary
Name: | 6-deoxy-2,3-di-O-methyl-beta-D-glucopyranose |
Formula: | C8 H16 O5 |
Formal charge: | 0 |
Formula weight: | 192.21 Da |
Component type: | D-saccharide, beta linking |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 6-deoxy-2,3-di-O-methyl-beta-D-glucopyranose |
OpenEye OEToolkits | 2.0.7 | (2~{R},3~{R},4~{S},5~{R},6~{R})-3,4-dimethoxy-6-methyl-oxane-2,5-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | OC1C(OC)C(OC)C(OC1C)O |
InChI | InChI | 1.03 | InChI=1S/C8H16O5/c1-4-5(9)6(11-2)7(12-3)8(10)13-4/h4-10H,1-3H3/t4-,5-,6+,7-,8-/m1/s1 |
InChIKey | InChI | 1.03 | SXWBIRCAXZNEGK-JAJWTYFOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CO[C@H]1[C@H](O)O[C@H](C)[C@@H](O)[C@@H]1OC |
SMILES | CACTVS | 3.385 | CO[CH]1[CH](O)O[CH](C)[CH](O)[CH]1OC |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)OC)OC)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1C(C(C(C(O1)O)OC)OC)O |