| SpectraBase Spectrum ID |
43jHiVBRT4O |
| Name |
5-[(3aS,4S,6aR)-2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl]valeric acid octyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H32N2O3S |
| InChI |
InChI=1S/C18H32N2O3S/c1-2-3-4-5-6-9-12-23-16(21)11-8-7-10-15-17-14(13-24-15)19-18(22)20-17/h14-15,17H,2-13H2,1H3,(H2,19,20,22)/t14-,15-,17-/m0/s1 |
| InChIKey |
AGTLBMMDWXIXPW-ZOBUZTSGSA-N |
| Molecular Weight |
356.525 g/mol |
| SMILES |
N1[C@@]2([C@@](SC[C@@]2(NC1=O)[H])(CCCCC(=O)OCCCCCCCC)[H])[H] |
| SPLASH |
splash10-0ar1-3459000000-7220378855049360c3f0 |
| Source of Spectrum |
SK-27-2213-11 |
| Synonyms |
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid octyl ester
Octyl 5-[(3aS,4S,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoate
Octyl 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoate |
| Wiley ID |
867982 |
![5-[(3aS,4S,6aR)-2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl]valeric acid octyl ester](/api/spectrum/43jHiVBRT4O/structure.png?h=300&w=458 "5-[(3aS,4S,6aR)-2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl]valeric acid octyl ester")
