| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:57:27 UTC |
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| Update Date | 2025-03-21 18:54:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00198297 |
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| Frequency | 11.3 |
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| Structure | |
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| Chemical Formula | C5H6O4 |
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| Molecular Mass | 130.0266 |
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| SMILES | O=C(O)CC1CC(=O)O1 |
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| InChI Key | XWHQJLZRDMZERL-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 | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | beta propiolactonescarbonyl compoundscarboxylic acid esterscarboxylic acidshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxetanes |
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| Substituents | carbonyl groupcarboxylic acidbeta_propiolactonelactoneoxacycleorganic oxideorganic oxygen compoundcarboxylic acid esteroxetanealiphatic heteromonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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