Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:53:39 UTC |
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Update Date | 2025-03-25 00:51:25 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02186850 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C13H21N3O2 |
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Molecular Mass | 251.1634 |
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SMILES | NCCCNCCCNC(=O)c1ccccc1O |
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InChI Key | HMCMIZGDIMGEQU-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 | benzoic acids and derivatives |
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Direct Parent | salicylamides |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsamino acids and derivativesbenzamidesbenzoyl derivativescarboxylic acids and derivativesdialkylamineshydrocarbon derivativesmonoalkylaminesorganic oxidesorganooxygen compoundsorganopnictogen compoundssecondary carboxylic acid amidesvinylogous acids |
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Substituents | amino acid or derivativesbenzoyl1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativebenzamideorganic oxideorganonitrogen compoundorganopnictogen compoundsecondary aliphatic amine1-hydroxy-4-unsubstituted benzenoidsecondary aminecarboxamide groupsalicylamidearomatic homomonocyclic compoundsecondary carboxylic acid amidevinylogous acidorganic oxygen compoundphenolhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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