| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:56:53 UTC |
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| Update Date | 2025-03-21 20:08:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00335627 |
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| Frequency | 5.7 |
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| Structure | |
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| Chemical Formula | C6H6N4 |
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| Molecular Mass | 134.0592 |
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| SMILES | Nc1cc2cncnc2[nH]1 |
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| InChI Key | YTTNJTYCOVSLSU-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 compoundsheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivativespyrroles |
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| Substituents | azacycleheteroaromatic compoundpyrimidinepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamine |
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