| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:05:18 UTC |
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| Update Date | 2025-03-21 18:28:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00074840 |
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| Frequency | 57.3 |
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| Structure | |
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| Chemical Formula | C7H13N3O3 |
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| Molecular Mass | 187.0957 |
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| SMILES | NC(N)=NCCCC(=O)CC(=O)O |
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| InChI Key | FBYMMKSFYQNWCI-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 | keto acids and derivatives |
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| Subclass | medium-chain keto acids and derivatives |
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| Direct Parent | medium-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | amino fatty acidsbeta-hydroxy ketonesbeta-keto acids and derivativescarboximidamidescarboxylic acidsfatty acylsguanidineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compounds |
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| Substituents | fatty acylbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupcarboxylic acidguanidineorganic 1,3-dipolar compoundcarboximidamidecarboxylic acid derivativeamino fatty acidbeta-keto acidpropargyl-type 1,3-dipolar organic compoundketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundmedium-chain keto acid |
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