| PDB CCD ID: | UWT |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C9 H20 O4 |
| InChI: | InChI=1S/C9H20O4/c1-7(11)5-12-9(3)6-13-8(2)4-10/h7-11H,4-6H2,1-3H3/t7-,8+,9-/m0/s1 |
| InChIKey: | LCZVSXRMYJUNFX-YIZRAAEISA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | C[CH](O)CO[CH](C)CO[CH](C)CO | | OpenEye OEToolkits 2.0.7 | CC(CO)OCC(C)OCC(C)O | | CACTVS 3.385 | C[C@H](O)CO[C@@H](C)CO[C@H](C)CO | | OpenEye OEToolkits 2.0.7 | C[C@H](CO)OC[C@H](C)OC[C@H](C)O |
|
| Name: | (2R)-2-[(2S)-2-[(2S)-2-oxidanylpropoxy]propoxy]propan-1-ol;
(2~{R})-2-[(2~{S})-2-[(2~{S})-2-oxidanylpropoxy]propoxy]propan-1-ol |
| ZINC: | ZINC000080360618 |
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