| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:26 UTC |
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| Update Date | 2025-03-21 18:35:37 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00106512 |
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| Frequency | 25.3 |
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| Structure | |
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| Chemical Formula | C12H10BrNO |
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| Molecular Mass | 262.9946 |
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| SMILES | OC(c1ccc(Br)cc1)c1ccccn1 |
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| InChI Key | RSFIOZZHCWYPAD-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 | halobenzenes |
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| Direct Parent | bromobenzenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaromatic alcoholsaryl bromidesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganobromidesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | aromatic alcoholaromatic heteromonocyclic compoundorganohalogen compoundorganonitrogen compoundorganopnictogen compound2-halopyridineorganoheterocyclic compoundalcoholazacycleheteroaromatic compoundhydroxypyridinebromobenzenearyl halidepyridineorganic oxygen compoundsecondary alcoholorganobromidehydrocarbon derivativeorganic nitrogen compoundaryl bromideorganooxygen compound |
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