| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:42 UTC |
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| Update Date | 2025-03-25 00:48:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02168612 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12N4O2 |
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| Molecular Mass | 208.096 |
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| SMILES | CC(C)(O)c1c[nH]c2[nH]c(N)nc(=O)c12 |
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| InChI Key | ZNKMTMUGIMEIGY-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 | aromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary aminespyrimidonespyrrolestertiary alcoholsvinylogous amides |
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| Substituents | aromatic alcoholalcoholvinylogous amideazacycleheteroaromatic compoundpyrimidonepyrimidinetertiary alcoholorganic oxidepyrrolo[2,3-d]pyrimidineorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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