| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:17 UTC |
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| Update Date | 2025-03-21 18:36:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111031 |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C12H18N4O8 |
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| Molecular Mass | 346.1125 |
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| SMILES | Nc1c(C(=O)OCC(N)C(=O)O)ncn1C1OC(CO)C(O)C1O |
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| InChI Key | ASHMTYJLRJAQKF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | nucleosides, nucleotides, and analogues |
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| Class | imidazole ribonucleosides and ribonucleotides |
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| Subclass | imidazole ribonucleosides and ribonucleotides |
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| Direct Parent | imidazole ribonucleosides and ribonucleotides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarbonylimidazolescarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesmonoalkylaminesmonosaccharidesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | carbonyl groupimidazole ribonucleosidecarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidmonosaccharidealpha-amino acid or derivativescarboxylic acid derivativesaccharideorganic oxideimidazoleorganonitrogen compoundalpha-amino acidorganopnictogen compoundimidazole-4-carbonyl groupprimary alcoholorganoheterocyclic compoundazolen-substituted imidazolealcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundcarboxylic acid estersecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeprimary aliphatic amineprimary amineorganic nitrogen compoundamineorganooxygen compound |
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