| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:49 UTC |
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| Update Date | 2025-03-25 00:47:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159791 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12N4O4 |
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| Molecular Mass | 264.0859 |
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| SMILES | O=c1nccnc2ncn(C3CC(O)C(CO)O3)c12 |
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| InChI Key | WSXHXCVEFAYSMK-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 | diazepines |
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| Subclass | 1,4-diazepines |
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| Direct Parent | 1,4-diazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesmonosaccharidesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholazacycletetrahydrofuranheteroaromatic compoundmonosaccharideoxacyclesaccharideorganic oxidepara-diazepineorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundprimary alcoholorganooxygen compoundazolen-substituted imidazole |
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