Metabolomics Structure Database
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MW REGNO: | 63548 |
Common Name: | N-carbamoylaspartic acid |
Systematic Name: | N-carbamoylaspartic acid |
RefMet Name: | N-Carbamoylaspartic acid |
Synonyms: | 2-Ureidobutanedioic acid; Carbamylaspartic acid; N-(Aminocarbonyl)-DL-aspartic acid; Ureidosuccinic acid [PubChem Synonyms] |
Exact Mass: | |
Formula: | C5H8N2O5 |
InChIKey: | HLKXYZVTANABHZ-UHFFFAOYSA-N |
ClassyFire superclass: | Organic acids and derivatives [C0000264] |
ClassyFire class: | Carboxylic acids and derivatives [C0000265] |
ClassyFire subclass: | Amino acids, peptides, and analogues [C0000013] |
ClassyFire direct parent: | Aspartic acid and derivatives [C0004317] |
Massbank MS spectra: | View MS spectra |
SMILES: | NC(=O)NC(CC(O)=O)C(O)=O |
Studies: | Available studies (via RefMet name) |
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References
LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200 ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y