| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:22:43 UTC |
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| Update Date | 2025-03-24 14:18:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00825298 |
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| Frequency | 1.8 |
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| Structure | |
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| Chemical Formula | C4H5ClO3 |
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| Molecular Mass | 135.9927 |
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| SMILES | O=C1OCC(O)C1Cl |
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| InChI Key | ZBFUIXXKJKQQKU-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 | lactones |
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| Subclass | gamma butyrolactones |
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| Direct Parent | gamma butyrolactones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkyl chloridescarbonyl compoundscarboxylic acid esterschlorohydrinshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesoxacyclic compoundssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholcarbonyl groupchlorohydrintetrahydrofuranhalohydrinalkyl chlorideorganochloridecarboxylic acid derivativeorganohalogen compoundgamma butyrolactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholalkyl halidehydrocarbon derivativeorganooxygen compound |
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