| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:16 UTC |
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| Update Date | 2025-03-21 18:32:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00089028 |
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| Frequency | 31.8 |
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| Structure | |
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| Chemical Formula | C9H12N6O3 |
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| Molecular Mass | 252.0971 |
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| SMILES | CC(O)C(O)c1nc2c(=O)nc(N)nc(N)c2[nH]1 |
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| InChI Key | MXKYVSXKMNFUIO-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 | 1,2-diols1,3-diazepinesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsorganic oxidesorganopnictogen compoundsprimary aminessecondary alcoholsvinylogous amides |
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| Substituents | aromatic alcoholmeta-diazepinealcoholvinylogous amideazacycleheteroaromatic compoundimidazo-meta-diazepineorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundimidolactamamineorganooxygen compoundazole1,2-diol |
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