Metabolomics Structure Database

 
MW REGNO: 70534
Common Name:Kinobscurinone
Systematic Name:4,9-dihydroxy-2-methyl-benzo[b]fluorene-5,10,11-trione
RefMet Name:Kinobscurinone
Synonyms:AC1NQZI8; C12391; 4,9-dihydroxy-2-methylbenzo[b]fluorene-5,10,11-trione; 4,9-Dihydroxy-2-methyl-11H-benzo[b]fluorene-5,10,11-trione [PubChem Synonyms]
Exact Mass:
306.0528 (neutral)    Calculate m/z:
Formula:C18H10O5
InChIKey:KESQQXMHWJFEFV-UHFFFAOYSA-N
ClassyFire superclass:Benzenoids [C0002448]
ClassyFire class:Naphthalenes [C0000023]
ClassyFire subclass:Naphthols and derivatives [C0002441]
ClassyFire direct parent:Naphthols and derivatives [C0002441]
SMILES:Cc1cc2c(C3=C(C2=O)C(=O)c2c(cccc2O)C3=O)c(O)c1
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

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

  logo