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(2~{R},3~{S},4~{S},5~{S})-5-fluoranyl-2-(hydroxymethyl)oxane-3,4-diol
Created: | 2019-11-27 |
Last modified: | 2024-09-27 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 22 |
Chiral Atom Count | 4 |
Bond Count | 22 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | (2~{R},3~{S},4~{S},5~{S})-5-fluoranyl-2-(hydroxymethyl)oxane-3,4-diol |
Systematic Name (OpenEye OEToolkits) | (2~{R},3~{S},4~{S},5~{S})-5-fluoranyl-2-(hydroxymethyl)oxane-3,4-diol |
Formula | C6 H11 F O4 |
Molecular Weight | 166.148 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | OC[CH]1OC[CH](F)[CH](O)[CH]1O |
SMILES | OpenEye OEToolkits | 2.0.7 | C1C(C(C(C(O1)CO)O)O)F |
Canonical SMILES | CACTVS | 3.385 | OC[C@H]1OC[C@H](F)[C@@H](O)[C@@H]1O |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)F |
InChI | InChI | 1.03 | InChI=1S/C6H11FO4/c7-3-2-11-4(1-8)6(10)5(3)9/h3-6,8-10H,1-2H2/t3-,4+,5+,6+/m0/s1 |
InChIKey | InChI | 1.03 | JEWFVWVAXVTBRL-SLPGGIOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 445257 |