Metabolomics Structure Database
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MW REGNO: | 38743 |
Common Name: | Homoanserine |
Systematic Name: | (2S)-2-(4-aminobutanamido)-3-(1-methyl-1H-imidazol-5-yl)propanoic acid |
Synonyms: | [PubChem Synonyms] |
Exact Mass: | |
Formula: | C11H18N4O3 |
InChIKey: | HXBKNURIXGGFCX-VIFPVBQESA-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: | Hybrid peptides [C0002010] |
SMILES: | Cn1cncc1C[C@@H](C(=O)O)NC(=O)CCCN |
Studies: | - |
Select appropriate tab below to view additional details:
External database links:
PubChem CID: | 20849429 |
CHEBI ID: | 172495 |
HMDB ID: | HMDB0005767 |
Chemspider ID: | 17216339 |
Plant Metabolite Hub(Pmhub): | MS000064540 |
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