| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:57:06 UTC |
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| Update Date | 2025-03-21 18:05:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00055285 |
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| Frequency | 57.9 |
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| Structure | |
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| Chemical Formula | C10H16NO3+ |
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| Molecular Mass | 198.1125 |
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| SMILES | C[N+](C)(C)C(Cc1ccco1)C(=O)O |
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| InChI Key | KDMXWFIFWIGEPP-UHFFFAOYSA-O |
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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 heteromonocyclic compounds |
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| Alternative Parents | aminescarbonyl compoundscarboxylic acidsfuransheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsoxacyclic compoundstetraalkylammonium salts |
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| Substituents | furancarbonyl groupcarboxylic acidtetraalkylammonium saltaromatic heteromonocyclic compoundquaternary ammonium saltheteroaromatic compoundoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltamineorganoheterocyclic compoundorganooxygen compound |
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