Metabolomics Structure Database

 
MW REGNO: 45627
Common Name:2-Biphenylol
Systematic Name:2-phenylphenol
Synonyms: [PubChem Synonyms]
Exact Mass:
170.0732 (neutral)    Calculate m/z:
Formula:C12H10O
InChIKey:LLEMOWNGBBNAJR-UHFFFAOYSA-N
ClassyFire superclass:Benzenoids [C0002448]
ClassyFire class:Benzene and substituted derivatives [C0002279]
ClassyFire subclass:Biphenyls and derivatives [C0000041]
ClassyFire direct parent:Biphenyls and derivatives [C0000041]
Massbank MS spectra:View MS spectra
SMILES:c1ccc(cc1)c1ccccc1O
Studies:Available studies(via PubChem CID)

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External database links:

PubChem CID:7017
CHEBI ID:17043
HMDB ID:HMDB0032582
KEGG ID:C02499
Chemspider ID:13839012
MetaCyc ID:CPD-946
Plant Metabolite Hub(Pmhub):MS000002526

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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