2-[2-[(e)-3-aminobut-2-enoyl]oxyethylsulfanyl]ethyl (z)-3-aminobut-2-enoate (CHEM168161)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-18 20:06:53 UTC | ||||||||
| Update Date | 2026-08-18 20:06:53 UTC | ||||||||
| Accession Number | CHEM168161 | ||||||||
| Identification | |||||||||
| Common Name | 2-[2-[(e)-3-aminobut-2-enoyl]oxyethylsulfanyl]ethyl (z)-3-aminobut-2-enoate | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-[2-[(e)-3-aminobut-2-enoyl]oxyethylsulfanyl]ethyl (z)-3-aminobut-2-enoate belongs to the fatty acid esters, a subclass of fatty acyls within the organic compounds. It has the chemical formula C12H20N2O4S and an average molecular weight of 288.37 g/mol. It is further classified as part of the lipids and lipid-like molecules superclass. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C12H20N2O4S | ||||||||
| Average Molecular Mass | 288.370 g/mol | ||||||||
| Monoisotopic Mass | 288.114 g/mol | ||||||||
| CAS Registry Number | 13560-49-1 | ||||||||
| IUPAC Name | 2-[2-[(E)-3-aminobut-2-enoyl]oxyethylsulfanyl]ethyl (Z)-3-aminobut-2-enoate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C12H20N2O4S/c1-9(13)7-11(15)17-3-5-19-6-4-18-12(16)8-10(2)14/h7-8H,3-6,13-14H2,1-2H3/b9-7-,10-8+ | ||||||||
| InChI Key | GZVBGWRBVGVPLI-FKJILZIQSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
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| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
