| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:08 UTC |
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| Update Date | 2025-03-21 18:03:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00043667 |
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| Frequency | 77.7 |
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| Structure | |
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| Chemical Formula | C12H17NO |
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| Molecular Mass | 191.131 |
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| SMILES | CCC(O)=NC(C)Cc1ccccc1 |
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| InChI Key | XIFQVHAIWLZAHL-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 | carboximidic acidshydrocarbon derivativesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsphenylpropanespropargyl-type 1,3-dipolar organic compounds |
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| Substituents | carboximidic acidorganic 1,3-dipolar compoundpropargyl-type 1,3-dipolar organic compoundphenylpropanearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamphetamine or derivatives |
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