| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:07:40 UTC |
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| Update Date | 2025-03-21 18:30:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00080627 |
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| Frequency | 36.0 |
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| Structure | |
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| Chemical Formula | C10H12N5O7P |
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| Molecular Mass | 345.0474 |
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| SMILES | Nc1nc2c(cnn2C2OC3COP(=O)(O)OC3C2O)c(=O)[nH]1 |
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| InChI Key | SQEXWWRLUHDIBP-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 derivativeslactamsmonosaccharidesorganic oxidesorganic phosphoric acids and derivativesorganopnictogen compoundsoxacyclic compoundsprimary aminespyrazolespyrazolo[3,4-d]pyrimidinespyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | lactampentose phosphatepyrimidonepyrazolepyrimidineorganic oxidepyrazolopyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazolepyrazolo[3,4-d]pyrimidinealcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundoxacyclesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeamine |
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