| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:03 UTC |
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| Update Date | 2025-03-25 00:58:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02228896 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H9NO7 |
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| Molecular Mass | 231.0379 |
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| SMILES | CC(=O)NC1C(=O)C(O)=C(O)OC1C(=O)O |
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| InChI Key | JZUROEGYIONWIK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyrans |
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| Subclass | pyran carboxylic acids and derivatives |
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| Direct Parent | pyran carboxylic acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetamidescarboxylic acidscyclic ketonesdihydropyranoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundssecondary carboxylic acid amidesvinylogous acidsvinylogous esters |
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| Substituents | carbonyl groupcarboxylic aciddihydropyranonecyclic ketonecarboxylic acid derivativeketoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundpyranoneorganopnictogen compoundacetamidepyran carboxylic acid or derivativesvinylogous estercarboxamide groupoxacyclesecondary carboxylic acid amidevinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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