| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:52 UTC |
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| Update Date | 2025-03-25 00:45:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02150815 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H17NO3 |
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| Molecular Mass | 211.1208 |
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| SMILES | COc1ccc(CC(N)C(O)CO)cc1 |
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| InChI Key | ULSYWRDTUIWPGG-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 | methoxylated amphetamines |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,2-diolsalkyl aryl ethersanisoleshydrocarbon derivativesmethoxybenzenesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsphenoxy compoundsprimary alcoholssecondary alcohols |
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| Substituents | alcoholphenol etherethermethoxylated amphetaminealkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundphenoxy compoundprimary alcoholorganooxygen compound1,2-diol |
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