Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:29:03 UTC |
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Update Date | 2025-03-21 18:40:59 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00131937 |
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Frequency | 19.2 |
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Structure | |
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Chemical Formula | C12H20N2O |
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Molecular Mass | 208.1576 |
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SMILES | CN(C)CC(O)C(N)Cc1ccccc1 |
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InChI Key | ZUMOPBMQTKDAPN-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 | 1,2-aminoalcoholsamphetamines and derivativeshydrocarbon derivativesmonoalkylaminesorganopnictogen compoundssecondary alcoholstrialkylamines |
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Substituents | alcohol1,2-aminoalcoholtertiary aliphatic aminearomatic homomonocyclic compoundphenylbutylamineorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundaminetertiary amineorganooxygen compoundamphetamine or derivatives |
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