| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:01 UTC |
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| Update Date | 2025-03-25 00:47:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160239 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H16N6O10P2 |
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| Molecular Mass | 454.0403 |
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| SMILES | Nc1nc(N)c2ncn(C3CC(O)C(COP(=O)(O)OP(=O)(O)O)O3)c2c(=O)n1 |
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| InChI Key | YIOCZYKIIJRVMF-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 | 1,3-diazepinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazodiazepinesimidazolesimidolactamsmonoalkyl phosphatesmonosaccharidesn-substituted imidazolesorganic oxidesorganic pyrophosphatesorganopnictogen compoundsoxacyclic compoundsprimary aminessecondary alcoholstetrahydrofurans |
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| Substituents | pentose phosphateimidazo-meta-diazepineimidazodiazepineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundimidolactamorganoheterocyclic compoundazolen-substituted imidazolemeta-diazepinealcoholazacycletetrahydrofuranheteroaromatic compoundorganic pyrophosphateoxacyclephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphate |
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