| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:13 UTC |
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| Update Date | 2025-03-25 00:56:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220368 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H18N3O3+ |
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| Molecular Mass | 276.1343 |
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| SMILES | C[N+](C)(C)C(Cc1c[nH]c2ccccc12)C(=O)[N+](=O)[O-] |
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| InChI Key | GCYNPSZIHYGNLR-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 acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aminesazacyclic compoundsbenzenoidsc-nitro compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesorganic cationsorganic oxidesorganic oxoanionic compoundsorganic oxoazanium compoundsorganic saltsorganopnictogen compoundspyrrolestetraalkylammonium salts |
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| Substituents | carbonyl groupindoleorganic nitro compoundorganic oxidearomatic heteropolycyclic compoundc-nitro compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganic cationorganic oxoazaniumorganic saltorganoheterocyclic compoundtetraalkylammonium saltazacyclequaternary ammonium saltheteroaromatic compoundindole or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compoundorganic hyponitrite |
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