| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:37 UTC |
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| Update Date | 2025-03-25 00:54:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02207212 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H12N6O3 |
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| Molecular Mass | 276.0971 |
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| SMILES | Nc1nc2[nH]cc(C3CCC(C(=O)O)N3)nc-2c(=O)n1 |
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| InChI Key | ATFYNNOZPNXHKW-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 | proline and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylaminesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsprimary aminespterins and derivativespyrazinespyrimidonespyrrolidine carboxylic acids |
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| Substituents | carbonyl groupcarboxylic acidamino acidpyrimidonepteridinepyrimidineorganic oxidearomatic heteropolycyclic compoundpyrrolidine carboxylic acidorganonitrogen compoundalpha-amino acidorganopnictogen compoundpyrrolidineorganoheterocyclic compoundproline or derivativessecondary aliphatic aminepterinazacycleheteroaromatic compoundsecondary aminemonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundpyrazinehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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