| SpectraBase Spectrum ID |
4q7mU7Mt82s |
| Name |
(3S,4S,6S,15E,17E,19E)-4,6-Dimethyl-4-hydroxy-3,6-peroxydocosa- 15,17,19-trienoic acid 1,4-lactone |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H38O4 |
| InChI |
InChI=1S/C24H38O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(2)20-24(3)21(27-28-23)19-22(25)26-24/h5-10,21H,4,11-20H2,1-3H3/b6-5+,8-7+,10-9+/t21-,23-,24-/m0/s1 |
| InChIKey |
AXDQPRBNYTZNDV-FONNPZOSSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np100461t |
| Molecular Weight |
390.564 g/mol |
| Optical Rotation |
[a]D20 = +29.1 (c = 1.1, CHCl3) |
| Reported Formula |
C24H38O4 |
| SMILES |
CC\C=C\C=C\C=C\CCCCCCCC[C@]1(C[C@]2([C@@](OO1)(CC(O2)=O)[H])C)C |
| SPLASH |
splash10-001s-9700000000-58f4fc8f4aa77790c1c2 |
| Source of Spectrum |
G4-73-1698-2 |
| Synonyms |
Plakortolide J |
| Wiley ID |
1848872 |
