| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:54 UTC |
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| Update Date | 2025-03-21 18:39:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00124395 |
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| Frequency | 20.7 |
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| Structure | |
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| Chemical Formula | C7H9N3O9P2 |
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| Molecular Mass | 340.9814 |
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| SMILES | Nc1ccn(C2OP(=O)(O)OC3OP(=O)(O)OC32)c(=O)n1 |
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| InChI Key | NTIFFHIPXZVWOH-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 | diazines |
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| Subclass | pyrimidines and pyrimidine derivatives |
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| Direct Parent | pyrimidones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsdioxaphospholanesheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic carbonic acids and derivativesorganic oxidesorganic phosphoric acids and derivativesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundsprimary amines |
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| Substituents | carbonic acid derivativeazacycleheteroaromatic compoundpyrimidone1,3_dioxaphospholaneoxacycleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundimidolactamorganic phosphoric acid derivativeamineorganooxygen compound |
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