| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:18 UTC |
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| Update Date | 2025-03-25 00:48:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02165439 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H8O3 |
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| Molecular Mass | 128.0473 |
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| SMILES | CCC(=O)C1CC(=O)O1 |
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| InChI Key | NTGKRSBGCFXRRL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | alpha-acyloxy ketones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | beta propiolactonescarboxylic acid estershydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compoundsoxetanes |
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| Substituents | alpha-acyloxy ketonecarboxylic acid derivativebeta_propiolactoneketonelactoneoxacycleorganic oxidemonocarboxylic acid or derivativescarboxylic acid esteroxetanealiphatic heteromonocyclic compoundhydrocarbon derivativeorganoheterocyclic compound |
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