| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:39:50 UTC |
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| Update Date | 2025-03-21 17:58:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00015063 |
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| Frequency | 290.2 |
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| Structure | |
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| Chemical Formula | C11H16N2O3 |
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| Molecular Mass | 224.1161 |
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| SMILES | CN(CCCC(O)c1cccc(O)c1)N=O |
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| InChI Key | PFYJCIXIRWLNCD-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 | phenylbutylamines |
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| Direct Parent | phenylbutylamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaromatic alcoholshydrocarbon derivativesorganic n-nitroso compoundsorganic oxidesorganopnictogen compoundssecondary alcohols |
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| Substituents | aromatic alcoholalcoholorganic nitroso compound1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundorganic n-nitroso compoundorganic oxidephenylbutylamineorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundphenolhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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