| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:23:01 UTC |
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| Update Date | 2025-03-21 18:37:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00117690 |
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| Frequency | 22.2 |
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| Structure | |
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| Chemical Formula | C14H20N5O10P |
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| Molecular Mass | 449.0948 |
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| SMILES | CC(O)C(O)c1cnc2c(n1)c(=O)nc(N)n2C1OC(COP(=O)(O)O)C(O)C1O |
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| InChI Key | PKMVGBDEJUKKPW-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 | aromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonoalkyl phosphatesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary aminespterins and derivativespyrazinespyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | aromatic alcoholpentose phosphatepentose-5-phosphatepyrimidonepteridinepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundalcoholvinylogous amidepterinazacycletetrahydrofuranheteroaromatic compoundoxacyclephosphoric acid estermonoalkyl phosphatepyrazinesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphate |
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