| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:41 UTC |
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| Update Date | 2025-03-25 00:58:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02230275 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H16N6O3 |
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| Molecular Mass | 340.1284 |
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| SMILES | CN(C)c1nc(=O)c2nc(CNc3ccc(C(=O)O)cc3)cnc2[nH]1 |
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| InChI Key | OSXUNDHEUIRUSX-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 | pteridines and derivatives |
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| Subclass | pterins and derivatives |
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| Direct Parent | pterins and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsaminopyrimidines and derivativesazacyclic compoundsbenzoic acidsbenzoyl derivativescarboxylic acidsdialkylarylaminesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsphenylalkylaminespyrazinespyrimidonessecondary alkylarylaminesvinylogous amides |
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| Substituents | monocyclic benzene moietycarboxylic acidamino acid or derivativesamino acidbenzoylpyrimidonecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundbenzoic aciddialkylarylaminevinylogous amidepterinazacycleheteroaromatic compoundbenzoic acid or derivativessecondary aminesecondary aliphatic/aromatic amineaminopyrimidinemonocarboxylic acid or derivativesorganic oxygen compoundpyrazinephenylalkylaminehydrocarbon derivativebenzenoidorganic nitrogen compoundamineorganooxygen compound |
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