| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:25 UTC |
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| Update Date | 2025-03-25 00:47:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02163388 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H10BrNO3 |
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| Molecular Mass | 306.9844 |
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| SMILES | O=C(Nc1ccc(Br)cc1)c1cc(O)ccc1O |
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| InChI Key | LXTIXDQTKYXYJF-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 | anilides |
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| Direct Parent | benzanilides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaryl bromidesbenzamidesbenzoyl derivativesbromobenzenescarboxylic acids and derivativeshydrocarbon derivativeshydroquinonesorganic oxidesorganobromidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundssalicylamidessecondary carboxylic acid amidesvinylogous acids |
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| Substituents | benzanilidebenzoyl1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganohalogen compoundbenzamideorganic oxideorganonitrogen compoundorganopnictogen compoundbromobenzenebenzoic acid or derivativescarboxamide groupsalicylamidearyl halidehydroquinonearomatic homomonocyclic compoundsecondary carboxylic acid amidevinylogous acidorganic oxygen compoundsalicylic acid or derivativesorganobromidephenolhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideorganooxygen compound |
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