| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:42:14 UTC |
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| Update Date | 2025-03-24 21:44:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01877512 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C8H7NO |
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| Molecular Mass | 133.0528 |
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| SMILES | C=C1Nc2ccccc2O1 |
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| InChI Key | XWPHROCGRQOCJK-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 | benzoxazolines |
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| Subclass | benzoxazolines |
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| Direct Parent | benzoxazolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundssecondary alkylarylamines |
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| Substituents | azacyclebenzoxazolinesecondary aminesecondary aliphatic/aromatic amineoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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