| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:19 UTC |
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| Update Date | 2025-03-25 00:56:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02218246 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H20N2O4 |
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| Molecular Mass | 256.1423 |
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| SMILES | Cc1nn(CC2OC(CO)C(O)C2O)c(C)c1C |
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| InChI Key | IYLJZAQBCCVBPQ-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 alcoholspyrazolessecondary alcoholstetrahydrofurans |
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| Substituents | alcoholetheraromatic heteromonocyclic compoundazacycletetrahydrofuranheteroaromatic compoundmonosaccharidedialkyl etherpyrazoleoxacycleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganoheterocyclic compoundazole |
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