| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:53 UTC |
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| Update Date | 2025-03-25 00:48:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02169045 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H23N3O5 |
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| Molecular Mass | 289.1638 |
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| SMILES | CC(C)CC(NC(=N)NOCCCCC(=O)O)C(=O)O |
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| InChI Key | UJGOFXGTBNPYJW-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 | leucine and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboximidamidescarboxylic acidsdicarboxylic acids and derivativesguanidineshydrocarbon derivativesiminesmethyl-branched fatty acidsorganic oxidesorganopnictogen compoundsshort-chain hydroxy acids and derivatives |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidmethyl-branched fatty acidshort-chain hydroxy acidguanidineiminefatty acidcarboximidamidebranched fatty acidorganic oxideorganic oxygen compoundleucine or derivativesorganonitrogen compoundalpha-amino aciddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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