| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:58 UTC |
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| Update Date | 2025-03-21 18:01:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00033650 |
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| Frequency | 115.1 |
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| Structure | |
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| Chemical Formula | C7H12N2O2 |
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| Molecular Mass | 156.0899 |
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| SMILES | CC1=NCCCC(C(=O)O)N1 |
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| InChI Key | DUXQJVAWRJYWOK-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,3-diazepinesamidinesazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidshydrocarbon derivativesimidolactamsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | meta-diazepinecarbonyl groupcarboxylic acidazacycleorganic 1,3-dipolar compoundamidinecarboximidamidepropargyl-type 1,3-dipolar organic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamorganoheterocyclic compoundorganooxygen compound |
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