| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:11 UTC |
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| Update Date | 2025-03-21 18:29:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077003 |
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| Frequency | 38.2 |
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| Structure | |
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| Chemical Formula | C9H13NO4 |
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| Molecular Mass | 199.0845 |
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| SMILES | OCC1OC(c2cc[nH]c2)C(O)C1O |
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| InChI Key | BKLYWYXBNDNVAW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | monosaccharides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkyl ethersheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrrolessecondary alcoholstetrahydrofurans |
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| Substituents | alcoholetheraromatic heteromonocyclic compoundazacycletetrahydrofuranheteroaromatic compoundmonosaccharidedialkyl etheroxacyclepyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganoheterocyclic compound |
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