| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:07:26 UTC |
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| Update Date | 2025-03-21 20:47:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00360609 |
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| Frequency | 5.2 |
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| Structure | |
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| Chemical Formula | C5H7ClO |
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| Molecular Mass | 118.0185 |
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| SMILES | CC(C)=CC(=O)Cl |
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| InChI Key | BDUBTLFQHNYXPC-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 | acyl halides |
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| Subclass | acyl chlorides |
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| Direct Parent | acyl chlorides |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundshydrocarbon derivativesorganic oxidesorganochlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundorganochlorideacyl chloridehydrocarbon derivativeorganooxygen compound |
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