Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:18:13 UTC |
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Update Date | 2025-03-21 18:35:30 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00105966 |
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Frequency | 25.5 |
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Structure | |
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Chemical Formula | C11H17N3O2 |
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Molecular Mass | 223.1321 |
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SMILES | CN(CCCC(O)c1ccccc1N)N=O |
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InChI Key | MHKNYJMFYOVHJB-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 | aromatic alcoholshydrocarbon derivativesorganic n-nitroso compoundsorganic oxidesorganopnictogen compoundsprimary aminessecondary alcohols |
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Substituents | aromatic alcoholalcoholorganic nitroso compoundaromatic homomonocyclic compoundorganic n-nitroso compoundorganic oxidephenylbutylamineorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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