| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:24 UTC |
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| Update Date | 2025-03-25 00:51:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02186231 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H17Cl2NO |
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| Molecular Mass | 273.0687 |
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| SMILES | NCCC1(c2ccc(Cl)c(Cl)c2)CCCCO1 |
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| InChI Key | OWIWWUJXOTVFJC-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 chloridesdialkyl ethershydrocarbon derivativesmonoalkylaminesorganochloridesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanes |
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| Substituents | aryl chlorideetheraromatic heteromonocyclic compoundorganochlorideorganohalogen compounddialkyl etheraryl halideoxacycleorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1,2-dichlorobenzeneprimary aliphatic amineorganic nitrogen compoundoxaneorganoheterocyclic compoundorganooxygen compound |
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