Metabolomics Structure Database

 
MW REGNO: 43714
Common Name:Salicylamide
Systematic Name:2-hydroxybenzamide
RefMet Name:Salicylamide
Synonyms: [PubChem Synonyms]
Exact Mass:
137.0477 (neutral)    Calculate m/z:
Formula:C7H7NO2
InChIKey:SKZKKFZAGNVIMN-UHFFFAOYSA-N
ClassyFire superclass:Benzenoids [C0002448]
ClassyFire class:Benzene and substituted derivatives [C0002279]
ClassyFire subclass:Benzoic acids and derivatives [C0000176]
ClassyFire direct parent:Salicylamides [C0002515]
Massbank MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:c1ccc(c(c1)C(=O)N)O
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:5147
CHEBI ID:32114
HMDB ID:HMDB0015687
Chemspider ID:4963
MetaCyc ID:SALICYLAMIDE
Natural Products Atlas ID:NP022113
NP-MRD ID(NMR):NP0016018
EPA CompTox DB:DTXCID501726
Plant Metabolite Hub(Pmhub):MS000000495

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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