| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:40 UTC |
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| Update Date | 2025-03-25 00:46:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02157270 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H9ClN2O |
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| Molecular Mass | 196.0403 |
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| SMILES | O=C1CNCN1c1ccc(Cl)cc1 |
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| InChI Key | RBUVLTJQKKAHEP-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 | azolidines |
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| Subclass | imidazolidines |
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| Direct Parent | phenylimidazolidines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsaryl chloridesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativeschlorobenzenesdialkylamineshydrocarbon derivativesimidazolidinoneslactamsorganic oxidesorganochloridesorganopnictogen compoundstertiary carboxylic acid amides |
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| Substituents | monocyclic benzene moietycarbonyl grouplactamphenylimidazolidinearomatic heteromonocyclic compoundamino acid or derivativesorganochloridealpha-amino acid or derivativescarboxylic acid derivativeorganohalogen compoundimidazolidinoneorganic oxidetertiary carboxylic acid amideorganonitrogen compoundalpha-amino acidorganopnictogen compoundaryl chloridechlorobenzenesecondary aliphatic amineazacyclesecondary aminecarboxamide grouparyl halideorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compoundamine |
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