| SpectraBase Spectrum ID |
76CpR8AYbPe |
| Name |
(2S,4S)-4-(acetylthio)-1-[(2S)-1-[(2S)-1-[(2S)-2-chloropropanoyl]prolyl]prolyl]pyrrolidine-2-carboxylic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30ClN3O6S |
| InChI |
InChI=1S/C21H30ClN3O6S/c1-12(22)18(27)23-8-4-6-15(23)19(28)24-9-5-7-16(24)20(29)25-11-14(32-13(2)26)10-17(25)21(30)31-3/h12,14-17H,4-11H2,1-3H3/t12-,14-,15-,16-,17-/m0/s1 |
| InChIKey |
JFGRIVHSTWMUKO-SRQBIAJPSA-N |
| Molecular Weight |
487.999 g/mol |
| SMILES |
C(N1[C@](C(=O)OC)(C[C@@](C1)(SC(=O)C)[H])[H])([C@]1(N(C([C@]2(N(C(=O)[C@@](Cl)(C)[H])CCC2)[H])=O)CCC1)[H])=O |
| SPLASH |
splash10-01p9-2910100000-6420dd6c59a82b0d4c7a |
| Source of Spectrum |
KC-0-3787-12 |
| Synonyms |
(2S,4S)-4-(acetylthio)-1-[[(2S)-1-[[(2S)-1-[(2S)-2-chloro-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester
Methyl (2S,4S)-1-[(2S)-1-[(2S)-1-[(2S)-2-chloranylpropanoyl]pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonyl-4-ethanoylsulfanyl-pyrrolidine-2-carboxylate
Methyl (2S,4S)-4-acetylsulfanyl-1-[(2S)-1-[(2S)-1-[(2S)-2-chloropropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate |
| Wiley ID |
826929 |
![(2S,4S)-4-(acetylthio)-1-[(2S)-1-[(2S)-1-[(2S)-2-chloropropanoyl]prolyl]prolyl]pyrrolidine-2-carboxylic acid methyl ester](/api/spectrum/76CpR8AYbPe/structure.png?h=300&w=458 "(2S,4S)-4-(acetylthio)-1-[(2S)-1-[(2S)-1-[(2S)-2-chloropropanoyl]prolyl]prolyl]pyrrolidine-2-carboxylic acid methyl ester")
