| SpectraBase Spectrum ID |
1wEEUE568iu |
| Name |
(1S*,11S*,12S*,15R*)-1-(Methoxycarbonyl)-12-[(phenylthio)methyl]-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one |
| Alternate Name(s) |
(1R*,11R*,12S*,15S*)-1-(Methoxycarbonyl)-12-[(phenylthio)methyl]-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one
Methyl (1S,11S,12S,15R)-16-oxo-12-[(phenylsulfanyl)methyl]-17-oxatricyclo[9.4.1.1(12,15)]heptadecane-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H34O4S |
| InChI |
InChI=1S/C25H34O4S/c1-28-23(27)25-16-11-6-4-2-3-5-10-14-20(22(25)26)24(17-15-21(25)29-24)18-30-19-12-8-7-9-13-19/h7-9,12-13,20-21H,2-6,10-11,14-18H2,1H3/t20-,21-,24-,25+/m1/s1 |
| InChIKey |
CKBIYPFTPBVHCE-YENTXNKWSA-N |
| Molecular Weight |
430.603 g/mol |
| SMILES |
[C@@]12(C([C@@](CCCCCCCCC2)([C@]2(O[C@@]1(CC2)[H])CSc1ccccc1)[H])=O)C(=O)OC |
| SPLASH |
splash10-0019-9066900000-aae08322b38981d6a8a5 |
| Source of Spectrum |
J-64-4128-15 |
| Wiley ID |
1530261 |
![(1S*,11S*,12S*,15R*)-1-(Methoxycarbonyl)-12-[(phenylthio)methyl]-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one](/api/spectrum/1wEEUE568iu/structure.png?h=300&w=458 "(1S*,11S*,12S*,15R*)-1-(Methoxycarbonyl)-12-[(phenylthio)methyl]-17-oxatricyclo[9.4.1.1(12,15)]heptadecan-16-one")
