| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:10:15 UTC |
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| Update Date | 2025-03-25 00:57:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224981 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H11N3O6 |
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| Molecular Mass | 269.0648 |
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| SMILES | Nc1nc2c(c(=O)[nH]1)COC(=O)C2(O)CCC(=O)O |
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| InChI Key | QDJKMMOKEVTWBV-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 | pyranopyrimidines |
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| Subclass | pyranopyrimidines |
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| Direct Parent | pyranopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamslactonesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary aminespyrimidonestertiary alcohols |
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| Substituents | pyranopyrimidinecarbonyl grouplactamcarboxylic acidamino acid or derivativesamino acidpyrimidonecarboxylic acid derivativepyrimidinelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundalcoholazacycleheteroaromatic compoundoxacycletertiary alcoholorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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