Metabolomics Structure Database
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MW REGNO: | 68367 |
Common Name: | Gentisyl alcohol |
Systematic Name: | 2-(hydroxymethyl)benzene-1,4-diol |
RefMet Name: | Gentisyl alcohol |
Synonyms: | 2,5-Dihydroxybenzyl alcohol; 3,6-Dihydroxybenzyl alcohol; 2-(hydroxymethyl)-1,4-benzenediol; 2-(hydroxymethyl)benzene-1,4-diol [PubChem Synonyms] |
Exact Mass: | |
Formula: | C7H8O3 |
InChIKey: | PUZSUVGRVHEUQO-UHFFFAOYSA-N |
ClassyFire superclass: | Benzenoids [C0002448] |
ClassyFire class: | Phenols [C0000134] |
ClassyFire subclass: | Benzenediols [C0001286] |
ClassyFire direct parent: | Hydroquinones [C0000136] |
Massbank MS spectra: | View MS spectra |
SMILES: | c1cc(c(cc1O)CO)O |
Studies: | Available studies (via RefMet name) |
Select appropriate tab below to view additional details:
External database links:
PubChem CID: | 188287 |
KEGG ID: | C10792 |
Plant Metabolite Hub(Pmhub): | MS000013669 |
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