| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:07 UTC |
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| Update Date | 2025-03-21 18:35:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00105720 |
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| Frequency | 25.5 |
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| Structure | |
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| Chemical Formula | C7H9NO5 |
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| Molecular Mass | 187.0481 |
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| SMILES | CC(=O)C=C(NCC(=O)O)C(=O)O |
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| InChI Key | VTWKNMWVSKNORG-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 | acryloyl compoundsamino acidscarboxylic acidsdialkylaminesdicarboxylic acids and derivativesenoneshydrocarbon derivativesketonesorganic oxidesorganopnictogen compoundsunsaturated fatty acidsvinylogous amides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidamino acidfatty acidalpha,beta-unsaturated ketoneketoneunsaturated fatty acidorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundenonevinylogous amidesecondary aliphatic aminesecondary amineorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivativeacryloyl-grouporganic nitrogen compoundorganooxygen compoundamine |
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