| SpectraBase Spectrum ID |
44XhJbNKQAq |
| Name |
(2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid 2,3-bis[(2E,4E,6E,8E,10E,12E)-1-oxodocosa-2,4,6,8,10,12-hexaenoxy]propyl ester |
| Alternate Name(s) |
(2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid 2,3-bis[[(2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoyl]oxy]propyl ester
2,3-bis[[(2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoyl]oxy]propyl (2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C69H98O6 |
| InChI |
InChI=1S/C69H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h28-63,66H,4-27,64-65H2,1-3H3/b31-28+,32-29+,33-30+,37-34+,38-35+,39-36+,43-40+,44-41+,45-42+,49-46+,50-47+,51-48+,55-52+,56-53+,57-54+,61-58+,62-59+,63-60+ |
| InChIKey |
XJLUMEKMCUOXCS-BPHZDVEQSA-N |
| Molecular Weight |
1023.537 g/mol |
| SMILES |
C(\C=C\C=C\C=C\C=C\C=C\C=C\CCCCCCCCC)(OC(COC(\C=C\C=C\C=C\C=C\C=C\C=C\CCCCCCCCC)=O)COC(\C=C\C=C\C=C\C=C\C=C\C=C\CCCCCCCCC)=O)=O |
| SPLASH |
splash10-0006-9000000000-3628b1314a81671a3527 |
| Source of Spectrum |
Va-0-0-0 |
| Wiley ID |
742705 |
![(2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid 2,3-bis[(2E,4E,6E,8E,10E,12E)-1-oxodocosa-2,4,6,8,10,12-hexaenoxy]propyl ester](/api/spectrum/44XhJbNKQAq/structure.png?h=300&w=458 "(2E,4E,6E,8E,10E,12E)-docosa-2,4,6,8,10,12-hexaenoic acid 2,3-bis[(2E,4E,6E,8E,10E,12E)-1-oxodocosa-2,4,6,8,10,12-hexaenoxy]propyl ester")
