| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:17:13 UTC |
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| Update Date | 2025-03-25 01:00:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02240612 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14N2O6 |
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| Molecular Mass | 258.0852 |
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| SMILES | CC(=O)c1cn(CC(O)C(O)CO)c(=O)[nH]c1=O |
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| InChI Key | IJJIGHDMLOJVPG-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 | carbonyl compounds |
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| Direct Parent | aryl alkyl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary alcoholspyrimidonessecondary alcoholsvinylogous amides |
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| Substituents | alcoholvinylogous amidecarbonic acid derivativelactamaryl alkyl ketonearomatic heteromonocyclic compoundazacycleheteroaromatic compoundpyrimidonepyrimidineorganic oxideorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganoheterocyclic compound |
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