| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:21:21 UTC |
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| Update Date | 2025-03-24 20:01:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01109059 |
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| Frequency | 1.2 |
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| Structure | |
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| Chemical Formula | C8H13NO |
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| Molecular Mass | 139.0997 |
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| SMILES | CC(C)(O)Cc1ccc[nH]1 |
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| InChI Key | XGYZHASWKMGOHT-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 derivativesorganonitrogen compoundsorganopnictogen compoundspyrrolestertiary alcohols |
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| Substituents | alcoholaromatic heteromonocyclic compoundazacycleheteroaromatic compoundtertiary alcoholorganic oxygen compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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