Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:49:55 UTC |
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Update Date | 2025-03-25 00:50:03 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02178347 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C9H10ClN |
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Molecular Mass | 167.0502 |
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SMILES | Clc1ccc(C2CNC2)cc1 |
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InChI Key | UPXXQMBUBSHBEZ-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 | azetidines |
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Subclass | phenylazetidines |
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Direct Parent | phenylazetidines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | aryl chloridesazacyclic compoundschlorobenzenesdialkylamineshydrocarbon derivativesorganochloridesorganopnictogen compounds |
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Substituents | aryl chloridechlorobenzenesecondary aliphatic aminemonocyclic benzene moietyaromatic heteromonocyclic compoundazacycle3-phenylazetidineorganochloridesecondary amineorganohalogen compoundaryl halideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneamine |
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