Hmdb loader
You are using an unsupported browser. Please upgrade your browser to a newer version to get the best experience on Human Metabolome Database.
Spectrum Details
HMDB ID:HMDB0260438
Compound Name:5-Amino-4-(2-hydroxy-3,4-dimethoxyphenyl)-6-(7-imino-6-methoxy-5,8-dioxoquinolin-2-yl)-3-methylpyridine-2-carboxylic acid
Derivative IUPAC Name:Not Available
Derivative SMILES:COC1=CC=C(C2=C(C)C(C(=O)O)=NC(C3=CC=C4C(=O)C(OC)C(=N)C(=O)C4=N3)=C2N[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C1OC
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - 5-Amino-4-(2-hydroxy-3,4-dimethoxyphenyl)-6-(7-imino-6-methoxy-5,8-dioxoquinolin-2-yl)-3-methylpyridine-2-carboxylic acid GC-MS (TBDMS_2_4) - 70eV, Positive
Splash Key:Not Available
Notes:This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification.
Spectrum View
Experimental Conditions
Ionization Mode:Positive
Ionization Energy:70 eV
Chromatography Type:Gas Chromatography Column (GC)
Instrument Type:Single quadrupole, spectrum predicted by CFM-ID(EI)
Mass Resolution:0.0001 Da
Molecular Formula:C25H22N4O8
Molecular Weight (Monoisotopic Mass):506.1438 Da
Derivative Type:TBDMS_2_4
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC=C(C2=C(C)C(C(=O)O)=NC(C3=CC=C4C(=O)C(OC)C(=N)C(=O)C4=N3)=C2N[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C1OC)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file750 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available