| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:29:20 UTC |
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| Update Date | 2025-03-21 18:41:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00132579 |
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| Frequency | 19.0 |
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| Structure | |
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| Chemical Formula | C11H10Cl2O2 |
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| Molecular Mass | 244.0058 |
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| SMILES | O=C1CCC(Cc2ccc(Cl)c(Cl)c2)O1 |
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| InChI Key | UPBXFQJTNZLXJQ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | dichlorobenzenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl chloridescarbonyl compoundscarboxylic acid estersgamma butyrolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesoxacyclic compoundstetrahydrofurans |
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| Substituents | aryl chloridecarbonyl grouparomatic heteromonocyclic compoundtetrahydrofuranorganochloridecarboxylic acid derivativeorganohalogen compoundgamma butyrolactonearyl halidelactoneoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivative1,2-dichlorobenzeneorganoheterocyclic compoundorganooxygen compound |
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