Metabolomics Structure Database

 
MW REGNO: 63105
Common Name:3-aminobenzamide
Systematic Name:3-aminobenzamide
RefMet Name:3-Aminobenzamide
Synonyms:3-H2NC6H4CONH2; 3-aminobenzoic acid amide; aniline-3-carboxamide; m-aminobenzamide; meta-aminobenzamide [PubChem Synonyms]
Exact Mass:
136.0637 (neutral)    Calculate m/z:
Formula:C7H8N2O
InChIKey:GSCPDZHWVNUUFI-UHFFFAOYSA-N
ClassyFire superclass:Benzenoids [C0002448]
ClassyFire class:Benzene and substituted derivatives [C0002279]
ClassyFire subclass:Benzoic acids and derivatives [C0000176]
ClassyFire direct parent:Aminobenzamides [C0001917]
SMILES:c1cc(cc(c1)N)C(=O)N
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

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