Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:23:25 UTC |
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Update Date | 2025-03-21 18:38:02 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00118640 |
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Frequency | 22.0 |
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Structure | |
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Chemical Formula | C10H11NO2 |
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Molecular Mass | 177.079 |
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SMILES | NC(Cc1ccccc1)C(O)=C=O |
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InChI Key | VFZWKMPQWQNRNX-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 | phenethylamines |
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Direct Parent | amphetamines and derivatives |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | benzene and substituted derivativeshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsynolates |
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Substituents | aromatic homomonocyclic compoundorganic oxideorganic oxygen compoundynolateorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamphetamine or derivatives |
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