| SpectraBase Spectrum ID |
IsHRX0wSBvP |
| Name |
Methyl threo-2-hydroxy-2-( 5'-acetyl-3'-nitro-2'-thienylthio)-3-( 4'-methoxyphenyl)propionate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17NO7S2 |
| InChI |
InChI=1S/C17H17NO7S2/c1-10(19)14-8-13(18(22)23)15(26-14)27-17(21,16(20)25-3)9-11-4-6-12(24-2)7-5-11/h4-8,21H,9H2,1-3H3 |
| InChIKey |
YZTJJGDKCXBVMS-UHFFFAOYSA-N |
| Molecular Weight |
411.443 g/mol |
| SMILES |
OC(Sc1c(cc(C(=O)C)s1)N(=O)=O)(C(=O)OC)Cc1ccc(cc1)OC |
| SPLASH |
splash10-00di-0900000000-ec5985d502f01fa248a3 |
| Source of Spectrum |
AH-126-574-10 |
| Synonyms |
Methyl erythro-2-hydroxy-2-( 5'-acetyl-3'-nitro-2'-thienylthio)-3-( 4'-methoxyphenyl)propionate
methyl 2-[(5-acetyl-3-nitro-2-thienyl)sulfanyl]-2-hydroxy-3-(4-methoxyphenyl)propanoate
Methyl erythro-2-hydroxy-2-(5'-acetyl-3'-nitro-2'-thienylthio)-3-(4'-methoxyphenyl)propionate
Methyl threo-2-hydroxy-2-(5'-acetyl-3'-nitro-2'-thienylthio)-3-(4'-methoxyphenyl)propionate |
| Wiley ID |
1374005 |
