| SpectraBase Compound ID | LWbzuFBp5xj |
|---|---|
| InChI | InChI=1S/C22H32O6/c1-15-9-5-7-11-20(26)28-22(18(4)14-24)16(2)10-6-8-12-19(25)27-21(15)17(3)13-23/h5-12,15-18,21-24H,13-14H2,1-4H3/b9-5+,10-6+,11-7+,12-8+ |
| InChIKey | BJKDBUCOMMKGPB-HFBXSBKTSA-N |
| Mol Weight | 392.5 g/mol |
| Molecular Formula | C22H32O6 |
| Exact Mass | 392.219889 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3Kplz5b5Z6U |
|---|---|
| Name | (3E,5E,11E,13E)-7,15-dimethyl-8,16-bis(1-oxidanylpropan-2-yl)-1,9-dioxacyclohexadeca-3,5,11,13-tetraene-2,10-dione |
| CAS Registry Number | 97690-89-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32O6 |
| InChI | InChI=1S/C22H32O6/c1-15-9-5-7-11-20(26)28-22(18(4)14-24)16(2)10-6-8-12-19(25)27-21(15)17(3)13-23/h5-12,15-18,21-24H,13-14H2,1-4H3/b9-5+,10-6+,11-7+,12-8+ |
| InChIKey | BJKDBUCOMMKGPB-HFBXSBKTSA-N |
| Molecular Weight | 392.492 g/mol |
| SMILES | OCC(C1C(\C=C\C=C\C(OC(C(CO)C)C(\C=C\C=C\C(O1)=O)C)=O)C)C |
| SPLASH | splash10-0059-6900000000-944b3a5758c06915aa2a |
| Synonyms | (3E,5E,11E,13E)-8,16-bis(1-hydroxypropan-2-yl)-7,15-dimethyl-1,9-dioxacyclohexadeca-3,5,11,13-tetraene-2,10-dione (3E,5E,11E,13E)-8,16-bis(2-hydroxy-1-methyl-ethyl)-7,15-dimethyl-1,9-dioxacyclohexadeca-3,5,11,13-tetraene-2,10-dione (3E,5E,11E,13E)-8,16-bis(2-hydroxy-1-methyl-ethyl)-7,15-dimethyl-1,9-dioxacyclohexadeca-3,5,11,13-tetraene-2,10-quinone 1,9-Dioxacyclohexadeca-3,5,11,13-tetraene-2,10-dione, 8,16-bis(2-hydroxy-1-methylethyl)-7,15-dimethyl-, [7S-[3E,5E,7R*,8R*(R*),11E,13E,15R*,16R*(R*)]]- 8,16-Bis(2-hydroxy-1-methylethyl)-7,15-dimethyl-1,9-dioxacyclohexadeca-3,5,11,13-tetraene-2,10-dione |
| Wiley ID | 1487661 |