| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:16:06 UTC |
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| Update Date | 2025-03-21 18:34:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00100741 |
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| Frequency | 27.2 |
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| Structure | |
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| Chemical Formula | C5H4Cl2O2 |
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| Molecular Mass | 165.9588 |
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| SMILES | ClC1C2OC2C2OC12Cl |
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| InChI Key | XQLINCCMUVNUBO-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 | dioxepanes |
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| Subclass | 1,4-dioxepanes |
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| Direct Parent | 1,4-dioxepanes |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | alkyl chloridesdialkyl ethersepoxideshydrocarbon derivativesorganochloridesoxacyclic compoundsoxanes |
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| Substituents | etheralkyl chlorideorganochloride1,4-dioxepaneoxiraneorganohalogen compounddialkyl etheraliphatic heteropolycyclic compoundoxacycleorganic oxygen compoundalkyl halidehydrocarbon derivativeoxaneorganooxygen compound |
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