| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:52 UTC |
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| Update Date | 2025-03-25 00:51:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02189628 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H19NO4 |
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| Molecular Mass | 265.1314 |
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| SMILES | CC(C)NCC(O)COc1ccc2c(c1)OCC2=O |
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| InChI Key | NWWROXHVIMGLDK-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 | alkyl aryl ethersaryl alkyl ketonescoumaransdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsphenol etherssecondary alcohols |
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| Substituents | phenol etheretheraryl alkyl ketonebenzofuranonealkyl aryl etherketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundcoumaranalcoholsecondary aliphatic aminesecondary amineoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaminearyl ketone |
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