| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:10 UTC |
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| Update Date | 2025-03-21 18:32:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091190 |
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| Frequency | 78.1 |
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| Structure | |
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| Chemical Formula | C9H12N4O3 |
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| Molecular Mass | 224.0909 |
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| SMILES | CC(O)C(O)c1c[nH]c2[nH]c(N)nc(=O)c12 |
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| InChI Key | LLETYMNYXPXXMS-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 | 1,2-diolsaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary aminespyrimidonespyrrolessecondary alcoholsvinylogous amides |
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| Substituents | aromatic alcoholalcoholvinylogous amideazacycleheteroaromatic compoundpyrimidonepyrimidineorganic oxidepyrrolo[2,3-d]pyrimidineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound1,2-diol |
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