| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:07 UTC |
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| Update Date | 2025-03-25 00:49:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176467 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H14N2O6 |
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| Molecular Mass | 246.0852 |
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| SMILES | O=C(O)CCC(NC(=O)C1COCN1)C(=O)O |
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| InChI Key | FONHGICNXBNBJY-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 | dipeptides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylaminesdicarboxylic acids and derivativesglutamic acid and derivativeshemiaminalsheterocyclic fatty acidshydrocarbon derivativesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxazolidinessecondary carboxylic acid amidesshort-chain hydroxy acids and derivatives |
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| Substituents | fatty acylcarbonyl groupcarboxylic acidshort-chain hydroxy acidamino acid or derivativesamino acidheterocyclic fatty acidfatty acidalpha-amino acid or derivativeshemiaminalorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundn-acyl-alpha amino acid or derivativessecondary aliphatic amineazacyclen-acyl-alpha-amino acidglutamic acid or derivativessecondary aminecarboxamide groupalpha-dipeptideoxacyclesecondary carboxylic acid amideorganic oxygen compoundoxazolidinedicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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