| SpectraBase Spectrum ID |
CqisCiO0McK |
| Name |
(1R*,11S*,12R*,14R*,15R*)-1-(Methoxycarbonyl)-12-methyl]-14-(phenylthio)-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H34O4S |
| InChI |
InChI=1S/C25H34O4S/c1-24-17-20(30-18-13-9-8-10-14-18)22(29-24)25(23(27)28-2)16-12-7-5-3-4-6-11-15-19(24)21(25)26/h8-10,13-14,19-20,22H,3-7,11-12,15-17H2,1-2H3/t19-,20-,22+,24-,25+/m1/s1 |
| InChIKey |
MBHNEQZGLZYCBN-CVBZCKAZSA-N |
| Molecular Weight |
430.603 g/mol |
| SMILES |
[C@]12([C@]3(O[C@]([C@@](C2=O)(CCCCCCCCC1)[H])(C)C[C@]3(Sc1ccccc1)[H])[H])C(=O)OC |
| SPLASH |
splash10-001i-0041900000-5b939f6b543996701090 |
| Source of Spectrum |
J-64-4129-15 |
| Wiley ID |
1530258 |
![(1R*,11S*,12R*,14R*,15R*)-1-(Methoxycarbonyl)-12-methyl]-14-(phenylthio)-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one](/api/spectrum/CqisCiO0McK/structure.png?h=300&w=458 "(1R*,11S*,12R*,14R*,15R*)-1-(Methoxycarbonyl)-12-methyl]-14-(phenylthio)-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one")
