| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:12 UTC |
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| Update Date | 2025-03-25 00:53:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199413 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H19N5O6 |
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| Molecular Mass | 341.1335 |
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| SMILES | N=c1[nH]c(=O)c2c(CNCC3(O)OCC(O)C(O)C3O)c[nH]c2[nH]1 |
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| InChI Key | BRDUUUYDABAKRW-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 | pyrrolopyrimidines |
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| Subclass | pyrrolo[2,3-d]pyrimidines |
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| Direct Parent | pyrrolo[2,3-d]pyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylamineshemiacetalsheteroaromatic compoundshydrocarbon derivativeslactamsmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanespyrimidonespyrrolessecondary alcoholsvinylogous amides |
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| Substituents | lactammonosaccharidepyrimidonepyrimidinesaccharideorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetaloxanealcoholvinylogous amidesecondary aliphatic amineazacycleheteroaromatic compoundsecondary amineoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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