| SpectraBase Spectrum ID |
9A1DPaU3OHQ |
| Name |
(E)-3-(methylsulfonyl)-propenoic acid (E)-2-[4-(3,7-dimethyl-2,6-octadienyloxy)-phenyl]-2-hydroxyethyl amide |
| Alternate Name(s) |
b-Hydroxygerambullin
(E)-N-(2-(4-(((E)-3,7-dimethylocta-2,6-dien-1-yl)oxy)phenyl)-2-hydroxyethyl)-3-(methylsulfonyl)acrylamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H31NO5S |
| InChI |
InChI=1S/C22H31NO5S/c1-17(2)6-5-7-18(3)12-14-28-20-10-8-19(9-11-20)21(24)16-23-22(25)13-15-29(4,26)27/h6,8-13,15,21,24H,5,7,14,16H2,1-4H3,(H,23,25)/b15-13+,18-12+ |
| InChIKey |
OFFSCPDQBGVPID-DDSGDGAWSA-N |
| Molecular Weight |
421.552 g/mol |
| SMILES |
N(CC(O)c1ccc(cc1)OC\C=C\(CCC=C(C)C)C)C(\C=C\S(=O)(=O)C)=O |
| SPLASH |
splash10-015c-9510000000-d9c987d1c7484d11300a |
| Source of Spectrum |
Otmar Hofer, et al. Phytochemistry, V. 54, 2000, P.207-213 |
| Wiley ID |
1817548 |
![(E)-3-(methylsulfonyl)-propenoic acid (E)-2-[4-(3,7-dimethyl-2,6-octadienyloxy)-phenyl]-2-hydroxyethyl amide](/api/spectrum/9A1DPaU3OHQ/structure.png?h=300&w=458 "(E)-3-(methylsulfonyl)-propenoic acid (E)-2-[4-(3,7-dimethyl-2,6-octadienyloxy)-phenyl]-2-hydroxyethyl amide")
