| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:33:36 UTC |
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| Update Date | 2025-03-21 17:56:10 UTC |
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| HMDB ID | HMDB0000034 |
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| Metabolite Identification |
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| DeepMet ID | DMID00000489 |
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| Name | Adenine |
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| Frequency | 15279.1 |
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| Structure | |
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| Chemical Formula | C5H5N5 |
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| Molecular Mass | 135.0545 |
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| SMILES | Nc1ncnc2nc[nH]c12 |
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| InChI Key | GFFGJBXGBJISGV-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 | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | purines and purine derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | azacycleheteroaromatic compoundpyrimidinearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundimidolactamamineazole |
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