| SpectraBase Spectrum ID |
4uXk2QA0Koo |
| Name |
(9E,12E)-Octadeca-9,12-dienoicacid 3-[3-dimethylamino-3-(ethyl-hydroxy-carbamoyl)-propoxy]-2-hexadecanoyloxy-propyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C45H84N2O7 |
| InChI |
InChI=1S/C45H84N2O7/c1-6-9-11-13-15-17-19-21-22-24-25-27-29-31-33-35-43(48)53-40-41(39-52-38-37-42(46(4)5)45(50)47(51)8-3)54-44(49)36-34-32-30-28-26-23-20-18-16-14-12-10-7-2/h15,17,21-22,41-42,51H,6-14,16,18-20,23-40H2,1-5H3/b17-15+,22-21+ |
| InChIKey |
UAJNLGQNWWLNNT-DGSHHMFQSA-N |
| Molecular Weight |
765.174 g/mol |
| SMILES |
ON(C(C(N(C)C)CCOCC(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCC\C=C\C\C=C\CCCCC)=O)CC |
| SPLASH |
splash10-01sr-9455108600-25684d4f72a913cc4516 |
| Source of Spectrum |
H-85-1442-1 |
| Synonyms |
3-{3-(dimethylamino)-4-[ethyl(hydroxy)amino]-4-oxobutoxy}-2-(palmitoyloxy)propyl (9E,12E)-9,12-octadecadienoate
3-{4'-[ethyl(hydroxy)amino]-3'-(dimethylamino)-4'-oxobutyl}-2-[(1''-oxohexyl)oxypropyl]octadeca-9,12-dienoate
Neoengleromycin |
| Wiley ID |
1524281 |
![(9E,12E)-Octadeca-9,12-dienoicacid 3-[3-dimethylamino-3-(ethyl-hydroxy-carbamoyl)-propoxy]-2-hexadecanoyloxy-propyl ester](/api/spectrum/4uXk2QA0Koo/structure.png?h=300&w=458 "(9E,12E)-Octadeca-9,12-dienoicacid 3-[3-dimethylamino-3-(ethyl-hydroxy-carbamoyl)-propoxy]-2-hexadecanoyloxy-propyl ester")
