| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:51 UTC |
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| Update Date | 2025-03-25 00:54:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02205478 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H19N5O3 |
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| Molecular Mass | 245.1488 |
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| SMILES | NC(N)=NC(=O)CNCCCCC(N)C(=O)O |
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| InChI Key | QKJWLQJITMINAJ-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 acyclic compounds |
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| Alternative Parents | amino acidsamino fatty acidscarbonyl compoundscarboximidamidescarboxylic acidsdialkylaminesguanidineshydrocarbon derivativesmedium-chain fatty acidsmonoalkylaminesmonocarboxylic acids and derivativesn-acyliminesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | n-acyliminefatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidguanidinefatty acidpropargyl-type 1,3-dipolar organic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundmedium-chain fatty acidsecondary aliphatic amineorganic 1,3-dipolar compoundcarboximidamidesecondary amineamino fatty acidmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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