| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:35 UTC |
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| Update Date | 2025-03-25 01:01:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252980 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H18N2O11 |
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| Molecular Mass | 402.0911 |
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| SMILES | O=C(O)C1=CC(=CC=NOC2OC(C(=O)O)C(O)C(O)C2O)CC(C(=O)O)N1 |
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| InChI Key | GYASYSFFYBPWLG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | glucuronic acid derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonosaccharidesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanespyran carboxylic acidssecondary alcoholstetrahydropyridinestricarboxylic acids and derivatives |
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| Substituents | carbonyl groupcarboxylic acidglucuronic acid or derivativesamino acid or derivativesamino acidmonosaccharidetricarboxylic acid or derivativesalpha-amino acid or derivativescarboxylic acid derivativepyran carboxylic acidbeta-hydroxy acidorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundoxaneorganoheterocyclic compoundalcoholsecondary aliphatic aminepyran carboxylic acid or derivativesazacycletetrahydropyridinehydroxy acidsecondary amineoxacyclepyransecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamine |
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