| SpectraBase Spectrum ID |
HOT6b1wmwR0 |
| Name |
Methyl erythro-2-hydroxy-3-(4-methoxyphenyl)-3-(3-acetylamino-2-thienylthio)propionate |
| Alternate Name(s) |
methyl 3-{[3-(acetylamino)-2-thienyl]sulfanyl}-2-hydroxy-3-(4-methoxyphenyl)propanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO5S2 |
| InChI |
InChI=1S/C17H19NO5S2/c1-10(19)18-13-8-9-24-17(13)25-15(14(20)16(21)23-3)11-4-6-12(22-2)7-5-11/h4-9,14-15,20H,1-3H3,(H,18,19)/t14-,15-/m0/s1 |
| InChIKey |
GGYUSPURVGXQDD-GJZGRUSLSA-N |
| Molecular Weight |
381.461 g/mol |
| SMILES |
O[C@@]([C@@](Sc1c(ccs1)NC(=O)C)(c1ccc(cc1)OC)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-00di-0900000000-65cfc825de74d539e8fb |
| Source of Spectrum |
H1-41-716-13 |
| Wiley ID |
757215 |
