| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:21:46 UTC |
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| Update Date | 2025-03-21 20:53:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00394593 |
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| Frequency | 4.6 |
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| Structure | |
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| Chemical Formula | C8H9NO |
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| Molecular Mass | 135.0684 |
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| SMILES | Nc1ccccc1CC=O |
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| InChI Key | NDDOLXKGDAEEAC-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 | phenylacetaldehydes |
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| Direct Parent | phenylacetaldehydes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha-hydrogen aldehydeshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary amines |
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| Substituents | carbonyl groupaldehydearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundalpha-hydrogen aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compoundphenylacetaldehyde |
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