| SpectraBase Spectrum ID |
3xkEurMf56 |
| Name |
Methyl (11S)-1.beta.-Phenylthio-3-oxo-eudesm-4-en-13-oate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O3S |
| InChI |
InChI=1S/C22H28O3S/c1-14(21(24)25-4)16-10-11-22(3)18(12-16)15(2)19(23)13-20(22)26-17-8-6-5-7-9-17/h5-9,14,16,20H,10-13H2,1-4H3/t14-,16+,20+,22+/m0/s1 |
| InChIKey |
IZQPJUSBCMIOGU-IERJYTTJSA-N |
| Molecular Weight |
372.523 g/mol |
| SMILES |
C=12[C@]([C@](Sc3ccccc3)(CC(C1C)=O)[H])(CC[C@](C2)([C@@](C(=O)OC)(C)[H])[H])C |
| SPLASH |
splash10-01t9-0592000000-015296b5f2b7c477ab19 |
| Source of Spectrum |
F-68-4426-3 |
| Synonyms |
Methyl (2S)-2-[(2R,4aR,5R)-4a,8-dimethyl-7-oxo-5-(phenylsulfanyl)-1,2,3,4,4a,5,6,7-octahydro-2-naphthalenyl]propanoate |
| Wiley ID |
1572613 |
