| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:32 UTC |
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| Update Date | 2025-03-25 01:01:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248317 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H15N4O8P |
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| Molecular Mass | 374.0628 |
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| SMILES | Cn1c(=O)c2nccnc2n(C2CC(O)C(COP(=O)(O)O)O2)c1=O |
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| InChI Key | LFPMBOZYQBIGGI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | pentose phosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkyl phosphatesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspteridines and derivativespyrazinespyrimidonessecondary alcoholstetrahydrofuransureasvinylogous amides |
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| Substituents | lactampentose phosphatepyrimidonepteridinepyrimidineureaorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundalcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacyclephosphoric acid estermonoalkyl phosphatepyrazinesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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