| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:38:37 UTC |
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| Update Date | 2025-03-21 18:47:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00154018 |
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| Frequency | 15.7 |
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| Structure | |
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| Chemical Formula | C4H9ClO2 |
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| Molecular Mass | 124.0291 |
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| SMILES | CC(O)(CO)CCl |
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| InChI Key | AVVXLRRTQZKHSP-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 | alcohols and polyols |
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| Direct Parent | tertiary alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-diolsalkyl chlorideschlorohydrinshydrocarbon derivativesorganochlorides |
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| Substituents | aliphatic acyclic compoundchlorohydrinhalohydrinalkyl chlorideorganochlorideorganohalogen compoundtertiary alcoholalkyl halidehydrocarbon derivative1,2-diol |
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