PDB CCD ID: | VNQ |
Number of entries in BioLiP: | 2 |
Chemical formula: | C7 H15 N O4 |
InChI: | InChI=1S/C7H15NO4/c1-8-4(2-9)6(11)7(12)5(8)3-10/h4-7,9-12H,2-3H2,1H3/t4-,5-,6-,7+/m1/s1 |
InChIKey: | YWBPEHFIHKFMMC-GBNDHIKLSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 2.0.7 | CN1C(C(C(C1CO)O)O)CO | CACTVS 3.385 | CN1[C@H](CO)[C@H](O)[C@H](O)[C@H]1CO | OpenEye OEToolkits 2.0.7 | CN1[C@@H]([C@H]([C@H]([C@H]1CO)O)O)CO | CACTVS 3.385 | CN1[CH](CO)[CH](O)[CH](O)[CH]1CO |
|
Name: | (2~{R},3~{S},4~{R},5~{R})-2,5-bis(hydroxymethyl)-1-methyl-pyrrolidine-3,4-diol |