| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:42 UTC |
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| Update Date | 2025-03-25 00:48:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02168615 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13NO2 |
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| Molecular Mass | 167.0946 |
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| SMILES | CC(C)(O)c1cc(O)ccc1N |
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| InChI Key | HFKNXYQNFYLESU-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 | phenylpropanes |
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| Direct Parent | phenylpropanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaromatic alcoholshydrocarbon derivativesorganopnictogen compoundsprimary aminestertiary alcohols |
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| Substituents | aromatic alcoholalcohol1-hydroxy-2-unsubstituted benzenoidphenylpropanearomatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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