| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:32 UTC |
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| Update Date | 2025-03-25 00:47:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161358 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H19N5O7 |
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| Molecular Mass | 345.1284 |
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| SMILES | NC(Cc1ncn(C2OC(CO)C(O)C2O)n1)C(=O)NCC(=O)O |
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| InChI Key | QFZUTDUEXVWKHM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | acyl glycines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdipeptidesfatty amidesheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholssecondary carboxylic acid amidestetrahydrofuranstriazole ribonucleosides and ribonucleotidestriazoles |
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| Substituents | fatty acyltriazolecarbonyl groupcarboxylic acidaromatic heteromonocyclic compoundfatty amidemonosaccharidealpha peptidesaccharideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundn-ribosyl-1,2,4-triazoleprimary alcoholorganoheterocyclic compoundazolealcoholalpha-amino acid amide1,2,4-triazoleazacycletetrahydrofuranheteroaromatic compoundcarboxamide groupn-acylglycinealpha-dipeptideoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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