Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:43:31 UTC |
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Update Date | 2025-03-21 17:59:47 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00023173 |
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Frequency | 170.0 |
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Structure | |
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Chemical Formula | C9H13N3O5 |
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Molecular Mass | 243.0855 |
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SMILES | Nc1c(C(=O)O)ncn1C1CC(O)C(CO)O1 |
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InChI Key | MORXYSHEYQVEMR-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 | azoles |
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Subclass | imidazoles |
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Direct Parent | carbonylimidazoles |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazolesmonocarboxylic acids and derivativesmonosaccharidesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminessecondary alcoholstetrahydrofuransvinylogous amides |
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Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acid or derivativesamino acidmonosaccharidecarboxylic acid derivativesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundimidazole-4-carbonyl groupprimary alcoholn-substituted imidazolealcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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