| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:02 UTC |
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| Update Date | 2025-03-25 00:47:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160253 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17N5O7 |
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| Molecular Mass | 343.1128 |
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| SMILES | Nc1nc(=O)c2c([nH]1)N(C1OC(CO)C(O)C1O)CC(C(=O)O)N2 |
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| InChI Key | CYILEPOYBYJMQY-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 | pterin carboxylates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylarylaminesheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminespyrimidonessecondary alcoholssecondary alkylarylaminestetrahydrofuransvinylogous amides |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidmonosaccharidepyrimidonealpha-amino acid or derivativescarboxylic acid derivativepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compounddialkylarylamineprimary alcoholalcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundpterin-6-carboxylatesecondary aminesecondary aliphatic/aromatic amineoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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