| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 04:09:30 UTC |
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| Update Date | 2025-03-21 23:09:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00649830 |
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| Frequency | 2.4 |
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| Structure | |
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| Chemical Formula | C6H7NO3 |
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| Molecular Mass | 141.0426 |
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| SMILES | O=C1C=C(C(=O)O)CNC1 |
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| InChI Key | DKIKHOPNGQAANU-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | alkaloids and derivatives |
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| Class | Not Available |
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| Subclass | alkaloids and derivatives |
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| Direct Parent | alkaloids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarboxylic acidscyclic ketonesdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | secondary aliphatic aminecarbonyl groupcarboxylic acidazacycleamino acid or derivativesamino acidcyclic ketonesecondary aminecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesalkaloid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundamine |
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