| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:11 UTC |
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| Update Date | 2025-03-25 00:45:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02151576 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H22N6O3 |
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| Molecular Mass | 298.1753 |
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| SMILES | N=C(N)NCCCC(N)C(=O)N1CCCC1C(=O)C(N)=O |
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| InChI Key | CRFIBKGYENSTDS-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 acid amides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsazacyclic compoundscarboximidamidescarboxylic acids and derivativesguanidineshydrocarbon derivativesiminesketonesmonoalkylaminesn-acylpyrrolidinesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidestertiary carboxylic acid amides |
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| Substituents | primary carboxylic acid amidecarbonyl groupguanidineiminen-acylpyrrolidineketoneorganic oxidetertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundalpha-amino acid amideazacyclecarboximidamidecarboxamide grouporganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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