SpectraBase Spectrum ID |
HSJgzD8u0ri |
Name |
(3aR,4R,6aS)-(-)-Hexahydro-3-methyl-2-oxo-1H-thieno-[3,4-d]imidazole-4-valeric acid |
CAS Registry Number |
64912-43-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H18N2O3S |
InChI |
InChI=1S/C11H18N2O3S/c1-13-10-7(12-11(13)16)6-17-8(10)4-2-3-5-9(14)15/h7-8,10H,2-6H2,1H3,(H,12,16)(H,14,15)/t7-,8-,10-/m1/s1 |
InChIKey |
WKLPIJMDCAIFAP-NQMVMOMDSA-N |
Molecular Weight |
258.336 g/mol |
SMILES |
OC(CCCC[C@@]1([C@@]2(N(C(N[C@@]2(CS1)[H])=O)C)[H])[H])=O |
SPLASH |
splash10-03di-8900000000-ddccfcaaf9244454125b |
Source of Spectrum |
J-43-1085-0 |
Synonyms |
5-[(3aR,4R,6aS)-3-methyl-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid |
Wiley ID |
1261322 |