| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:18:16 UTC |
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| Update Date | 2025-03-21 22:14:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00528331 |
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| Frequency | 3.2 |
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| Structure | |
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| Chemical Formula | C6H5NO |
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| Molecular Mass | 107.0371 |
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| SMILES | O=C=Cc1ccc[nH]1 |
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| InChI Key | RHOLQVKJLWUVHS-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundshydrocarbon derivativesketenesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolesynolates |
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| Substituents | aromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideorganic oxygen compoundynolatepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundketeneorganooxygen compound |
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