| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:37 UTC |
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| Update Date | 2025-03-25 01:01:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02250817 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12O7 |
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| Molecular Mass | 232.0583 |
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| SMILES | O=C(O)CC1(C(=O)O)CCC(C(=O)O)CO1 |
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| InChI Key | CXQYOTYQRWEJCQ-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 | carbonyl compoundscarboxylic acidsdialkyl ethershydrocarbon derivativesorganic oxidesoxacyclic compoundsoxanestricarboxylic acids and derivatives |
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| Substituents | carbonyl groupethercarboxylic acidpyran carboxylic acid or derivativestricarboxylic acid or derivativescarboxylic acid derivativedialkyl etheroxacycleorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundhydrocarbon derivativeoxaneorganooxygen compound |
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