| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:57:35 UTC |
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| Update Date | 2025-03-21 20:08:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00337262 |
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| Frequency | 5.7 |
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| Structure | |
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| Chemical Formula | C4H9ClO |
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| Molecular Mass | 108.0342 |
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| SMILES | CC(O)C(C)Cl |
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| InChI Key | XKEHIUIIEXXHJX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organohalogen compounds |
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| Class | halohydrins |
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| Subclass | chlorohydrins |
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| Direct Parent | chlorohydrins |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl chlorideshydrocarbon derivativesorganochloridessecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundchlorohydrinalkyl chlorideorganochlorideorganic oxygen compoundsecondary alcoholalkyl halidehydrocarbon derivativeorganooxygen compound |
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