| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:19 UTC |
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| Update Date | 2025-03-21 18:06:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065266 |
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| Frequency | 47.0 |
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| Structure | |
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| Chemical Formula | C8H13N3O3 |
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| Molecular Mass | 199.0957 |
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| SMILES | CC1=NCCC(C(=O)NCC(=O)O)N1 |
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| InChI Key | GGTJDQLROMBKRO-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 | acyl glycines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsamidinesazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidsdipeptideshydrocarbon derivativeshydropyrimidinesimidolactamsmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl groupcarboxylic acidamidinealpha peptidepropargyl-type 1,3-dipolar organic compoundorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidhydropyrimidineorganopnictogen compoundimidolactamorganoheterocyclic compound1,4,5,6-tetrahydropyrimidinealpha-amino acid amideazacycleorganic 1,3-dipolar compoundcarboximidamidecarboxamide groupn-acylglycinealpha-dipeptidesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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