| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:55 UTC |
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| Update Date | 2025-03-21 18:02:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00035936 |
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| Frequency | 98.8 |
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| Structure | |
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| Chemical Formula | C9H14N2O5 |
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| Molecular Mass | 230.0903 |
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| SMILES | O=C(O)CNC(=O)CCN1CCC1C(=O)O |
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| InChI Key | PCQKLUBQZCXWQI-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 | acyl glycines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundsazetidinecarboxylic acidsazetidinesbeta amino acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesorganopnictogen compoundssecondary carboxylic acid amidestrialkylamines |
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| Substituents | carbonyl groupcarboxylic acidamino acidazetidinecarboxylic acidorganic oxidealiphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundtertiary amineorganoheterocyclic compoundazacycletertiary aliphatic aminecarboxamide groupn-acylglycinebeta amino acid or derivativesazetidinesecondary carboxylic acid amideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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