| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:04:15 UTC |
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| Update Date | 2025-03-21 18:28:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00072344 |
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| Frequency | 41.3 |
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| Structure | |
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| Chemical Formula | C14H22N2O2 |
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| Molecular Mass | 250.1681 |
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| SMILES | CCN(CCO)CC(=O)Nc1c(C)cccc1C |
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| InChI Key | GSQUZNNMHWXVMP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acid amides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,2-aminoalcoholsalcohols and polyolsalpha amino acidsanilidescarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesn-arylamidesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestrialkylaminesm-xylenes |
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| Substituents | monocyclic benzene moietycarbonyl groupn-arylamidexyleneorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundtertiary aminealkanolaminealcoholalpha-amino acid amide1,2-aminoalcoholtertiary aliphatic aminem-xylenecarboxamide grouparomatic homomonocyclic compoundanilidesecondary carboxylic acid amideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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