7JZ
2-deoxy-2,2-difluoro-beta-D-lyxo-hexopyranose
Created: | 2009-05-19 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 23 |
Chiral Atom Count | 4 |
Bond Count | 23 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 2-deoxy-2,2-difluoro-beta-D-lyxo-hexopyranose |
Synonyms | 2-DEOXY-2,2-DIFLUORO-BETA-D-GALACTOPYRANOSYL-ENZYME INTERMEDIATE; 2-deoxy-2,2-difluoro-beta-D-lyxo-hexose; 2-deoxy-2,2-difluoro-D-lyxo-hexose; 2-deoxy-2,2-difluoro-lyxo-hexose |
Systematic Name (OpenEye OEToolkits) | (2R,4S,5R,6R)-3,3-difluoro-6-(hydroxymethyl)oxane-2,4,5-triol |
Formula | C6 H10 F2 O5 |
Molecular Weight | 200.137 |
Type | D-SACCHARIDE, BETA LINKING |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | FC1(F)C(O)C(O)C(OC1O)CO |
SMILES | CACTVS | 3.341 | OC[CH]1O[CH](O)C(F)(F)[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C1C(C(C(C(O1)O)(F)F)O)O)O |
Canonical SMILES | CACTVS | 3.341 | OC[C@H]1O[C@@H](O)C(F)(F)[C@@H](O)[C@H]1O |
Canonical SMILES | OpenEye OEToolkits | 1.5.0 | C([C@@H]1[C@@H]([C@@H](C([C@@H](O1)O)(F)F)O)O)O |
InChI | InChI | 1.03 | InChI=1S/C6H10F2O5/c7-6(8)4(11)3(10)2(1-9)13-5(6)12/h2-5,9-12H,1H2/t2-,3+,4+,5-/m1/s1 |
InChIKey | InChI | 1.03 | SHBCJQOMZTUYEL-MGCNEYSASA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 44237111 |