| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:46 UTC |
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| Update Date | 2025-03-25 00:50:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182553 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17N4O8P |
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| Molecular Mass | 376.0784 |
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| SMILES | O=P(O)(O)OCC1OC(NCc2c[nH]c3ncnc(O)c23)C(O)C1O |
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| InChI Key | GKARGSAAZQWHNZ-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 | 1,2-diolsazacyclic compoundsdialkylamineshemiaminalsheteroaromatic compoundshydrocarbon derivativeshydroxypyrimidinesmonoalkyl phosphatesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundspyrrolespyrrolo[2,3-d]pyrimidinessecondary alcoholstetrahydrofurans |
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| Substituents | pentose phosphatepentose-5-phosphatehydroxypyrimidinehemiaminalpyrimidinepyrrolopyrimidineorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compound1,2-diolalcoholsecondary aliphatic amineazacycletetrahydrofuranheteroaromatic compoundsecondary amineoxacyclephosphoric acid estermonoalkyl phosphatepyrrolesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateamine |
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