| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:48:39 UTC |
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| Update Date | 2025-03-21 18:01:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00035272 |
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| Frequency | 101.2 |
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| Structure | |
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| Chemical Formula | C11H18NO2+ |
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| Molecular Mass | 196.1332 |
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| SMILES | C[N+](C)(C)CCc1ccc(O)c(O)c1 |
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| InChI Key | VDTBORSEFUUDTP-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | phenols |
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| Subclass | benzenediols |
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| Direct Parent | catecholamines and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsamineshydrocarbon derivativesorganic cationsorganic saltsorganooxygen compoundsorganopnictogen compoundsphenethylaminestetraalkylammonium salts |
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| Substituents | monocyclic benzene moietytetraalkylammonium saltquaternary ammonium salt1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidphenethylaminecatecholaminearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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