| SpectraBase Spectrum ID |
DuV4Rv2wbtF |
| Name |
3-Cyclopentene-1-heptanoic acid, 4-[(2-hydroxyheptyl)thio]-2-oxo-, methyl ester, (2S)- |
| CAS Registry Number |
82542-34-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H34O4S |
| InChI |
InChI=1S/C20H34O4S/c1-3-4-7-11-17(21)15-25-18-13-16(19(22)14-18)10-8-5-6-9-12-20(23)24-2/h14,16-17,21H,3-13,15H2,1-2H3/t16?,17-/m0/s1 |
| InChIKey |
QYJARMPHPXWALL-DJNXLDHESA-N |
| Molecular Weight |
370.548 g/mol |
| SMILES |
O[C@](CSC1=CC(C(CCCCCCC(=O)OC)C1)=O)(CCCCC)[H] |
| SPLASH |
splash10-0abd-9521000000-2d2d2bb86b4bf536ceb1 |
| Source of Spectrum |
F-38-158-0 |
| Synonyms |
4(R)-2-(6-methoxycarbonylhexyl)-4-[2(S)-hydroxyheptylthio]-cyclopentenone
Methyl 7-(4-{[(2S)-2-hydroxyheptyl]sulfanyl}-2-oxo-3-cyclopenten-1-yl)heptanoate |
| Wiley ID |
1354258 |
![3-Cyclopentene-1-heptanoic acid, 4-[(2-hydroxyheptyl)thio]-2-oxo-, methyl ester, (2S)-](/api/spectrum/DuV4Rv2wbtF/structure.png?h=300&w=458 "3-Cyclopentene-1-heptanoic acid, 4-[(2-hydroxyheptyl)thio]-2-oxo-, methyl ester, (2S)-")
