| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:40 UTC |
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| Update Date | 2025-03-21 18:06:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00066119 |
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| Frequency | 46.2 |
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| Structure | |
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| Chemical Formula | C9H12N5O7P |
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| Molecular Mass | 333.0474 |
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| SMILES | Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)OC1O |
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| InChI Key | UKLRGQOEUIPQSI-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 | 1,3-dioxolanesacetalsazacyclic compoundshemiacetalsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsmonoalkyl phosphatesn-substituted imidazolesorganic oxidesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsprimary aminespyrimidines and pyrimidine derivatives |
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| Substituents | meta-dioxolanepyrimidineorganic oxideacetalaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhemiacetalimidolactamazolen-substituted imidazoleazacycleheteroaromatic compoundoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatehydrocarbon derivativeprimary aminepurineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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