| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:57 UTC |
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| Update Date | 2025-03-25 00:50:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182969 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H16N4O12P2 |
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| Molecular Mass | 458.024 |
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| SMILES | O=c1cc2ncn(CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)O)c2nc(=O)[nH]1 |
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| InChI Key | IGEUEIAATIEVRZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | imidazodiazepines |
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| Subclass | imidazodiazepines |
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| Direct Parent | imidazodiazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,3-diazepinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsmonoalkyl phosphatesn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganic pyrophosphatesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | lactamimidazo-meta-diazepineimidazodiazepineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolen-substituted imidazolemeta-diazepinealcoholcarbonic acid derivativeazacycleheteroaromatic compoundorganic pyrophosphateorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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