POG
Summary
Name: | (20S)-2,5,8,11,14,17-HEXAMETHYL-3,6,9,12,15,18-HEXAOXAHENICOSANE-1,20-DIOL |
Synonyms: | POLYPROPYLENE GLYCOL HEPTAPROPYLENE GLYCOL |
Formula: | C21 H44 O8 |
Formal charge: | 0 |
Formula weight: | 424.569 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (20R)-2,5,8,11,14,17-hexamethyl-3,6,9,12,15,18-hexaoxahenicosane-1,20-diol |
OpenEye OEToolkits | 1.5.0 | (2R)-1-[(2S)-1-[(2R)-1-[(2R)-1-[(2R)-1-[(2R)-1-[(2R)-1-hydroxypropan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-yl]oxypropan-2-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O(CC(O)C)C(COC(C)COC(C)COC(C)COC(C)COC(C)CO)C |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](O)COC(C)COC(C)COC(C)COC(C)COC(C)COC(C)CO |
SMILES | CACTVS | 3.341 | C[CH](O)COC(C)COC(C)COC(C)COC(C)COC(C)COC(C)CO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H](CO)OC[C@@H](C)OC[C@@H](C)OC[C@@H](C)OC[C@@H](C)OC[C@H](C)OC[C@@H](C)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(CO)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)O |
InChI | InChI | 1.03 | InChI=1S/C21H44O8/c1-15(23)9-24-17(3)11-26-19(5)13-28-21(7)14-29-20(6)12-27-18(4)10-25-16(2)8-22/h15-23H,8-14H2,1-7H3/t15-,16?,17?,18?,19?,20?,21?/m1/s1 |
InChIKey | InChI | 1.03 | OWRNLGZKEZSHGO-QAWAPDBNSA-N |