| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:07 UTC |
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| Update Date | 2025-03-25 01:00:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245062 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H16N2O2 |
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| Molecular Mass | 232.1212 |
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| SMILES | CN1CCN(C2Oc3ccccc3C2=O)CC1 |
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| InChI Key | JQFZCWHICHRMNW-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 | benzofurans |
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| Subclass | benzofuranones |
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| Direct Parent | benzofuranones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | aryl alkyl ketonesazacyclic compoundsbenzenoidscoumaranshydrocarbon derivativesn-methylpiperazinesorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundstrialkylamines |
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| Substituents | aryl alkyl ketonebenzofuranoneketoneorganic oxidepiperazinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundtertiary aminecoumaranazacyclen-alkylpiperazinetertiary aliphatic aminen-methylpiperazineoxacycleorganic oxygen compound1,4-diazinanehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compoundaryl ketone |
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