PDB CCD ID: | FMO |
Number of entries in BioLiP: | 0 |
Chemical formula: | C12 H19 F3 O9 |
InChI: | InChI=1S/C12H19F3O9/c13-11-12(14,15)9(21)8(4(2-17)23-11)24-10-7(20)6(19)5(18)3(1-16)22-10/h3-11,16-21H,1-2H2/t3-,4-,5-,6+,7-,8-,9+,10-,11+/m1/s1 |
InChIKey: | XXSHXGUAEVMBMC-DEIBAFIGSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 1.9.2 | C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@H](O[C@@H](C([C@H]2O)(F)F)F)CO)O)O)O)O | CACTVS 3.385 | OC[CH]1O[CH](O[CH]2[CH](O)C(F)(F)[CH](F)O[CH]2CO)[CH](O)[CH](O)[CH]1O | OpenEye OEToolkits 1.9.2 | C(C1C(C(C(C(O1)OC2C(OC(C(C2O)(F)F)F)CO)O)O)O)O | ACDLabs 12.01 | FC2(F)C(O)C(OC1OC(C(O)C(O)C1O)CO)C(OC2F)CO | CACTVS 3.385 | OC[C@H]1O[C@H](O[C@H]2[C@H](O)C(F)(F)[C@@H](F)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O |
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Name: | 2-deoxy-2,2-difluoro-4-O-alpha-D-glucopyranosyl-alpha-D-arabino-hexopyranosyl fluoride; 1,2,2-trifluoromaltose |