PDB CCD ID: | W25 |
Number of entries in BioLiP: | 1 |
Chemical formula: | C8 H6 F2 O3 |
InChI: | InChI=1S/C8H6F2O3/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,11H,(H,12,13)/t7-/m1/s1 |
InChIKey: | BKHXODARAOCNDJ-SSDOTTSWSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | O[C@@H](C(O)=O)c1ccc(F)c(F)c1 | OpenEye OEToolkits 2.0.7 | c1cc(c(cc1C(C(=O)O)O)F)F | OpenEye OEToolkits 2.0.7 | c1cc(c(cc1[C@H](C(=O)O)O)F)F | CACTVS 3.385 | O[CH](C(O)=O)c1ccc(F)c(F)c1 | ACDLabs 12.01 | Fc1ccc(cc1F)C(O)C(=O)O |
|
Name: | (2R)-(3,4-difluorophenyl)(hydroxy)acetic acid |
ZINC: | ZINC000002169776 |