| SpectraBase Spectrum ID |
9o2q8uyoC66 |
| Name |
Neurymenolide A Acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H34O4 |
| InChI |
InChI=1S/C26H34O4/c1-3-4-5-11-14-17-22-18-15-12-9-7-6-8-10-13-16-19-23-20-24(29-21(2)27)25(22)26(28)30-23/h4-5,7,9,14-15,17-18,20,22H,3,6,8,10-13,16,19H2,1-2H3/b5-4-,9-7-,17-14+,18-15-/t22-/m0/s1 |
| InChIKey |
ATFCQTQLMPKCQT-YBVKOODUSA-N |
| Literature Reference DOI |
10.1002/anie.201203180 |
| Molecular Weight |
410.554 g/mol |
| SMILES |
C=1(C=C2OC(C1[C@](\C=C/C\C=C/CCCCCC2)(\C=C\C\C=C/CC)[H])=O)OC(C)=O |
| SPLASH |
splash10-014m-9466300000-2758b4d8a4f5dab566fb |
| Source of Spectrum |
ACI-51-SMS11-2 |
| Synonyms |
(S,1(3)E,1(5)Z,3Z,6Z)-2-((1E,4Z)-hepta-1,4-dien-1-yl)-1(2)-oxo-1(2)H-1(3,6)-pyranacyclotridecaphane-3,6-dien-1(4)-yl acetate |
| Wiley ID |
1780391 |
