| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:56 UTC |
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| Update Date | 2025-03-25 00:57:22 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224331 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13NO6 |
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| Molecular Mass | 231.0743 |
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| SMILES | O=C(O)C1=CC2OC(CO)C(O)C(O)C2N1 |
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| InChI Key | IGESAMRZOFWEOR-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 | alpha amino acids |
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| Geometric Descriptor | aliphatic heteropolycyclic compounds |
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| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkyl ethersdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyrroline 2-carboxylic acidssecondary alcohols |
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| Substituents | carbonyl groupethercarboxylic acidamino acidmonosaccharidedialkyl etheraliphatic heteropolycyclic compoundsaccharideorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundoxaneprimary alcoholorganoheterocyclic compoundalcoholsecondary aliphatic amineazacyclepyrroline carboxylic acid or derivativessecondary aminepyrroline 2-carboxylic acidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolinepyrroline carboxylic acidsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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