| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:49 UTC |
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| Update Date | 2025-03-25 00:47:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02162001 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H23NO8 |
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| Molecular Mass | 321.1424 |
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| SMILES | O=C(O)C1CCCN1CCOC1C(O)OC(CO)C(O)C1O |
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| InChI Key | OZFWOVZQKQHENB-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 | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkyl ethershemiacetalshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesn-alkylpyrrolidinesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholspyrrolidine carboxylic acidssecondary alcoholstrialkylamines |
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| Substituents | carbonyl groupethercarboxylic acidamino acidmonosaccharidedialkyl ethersaccharideorganic oxidepyrrolidine carboxylic acidaliphatic heteromonocyclic compoundalpha-amino acidorganonitrogen compoundorganopnictogen compoundhemiacetaloxanepyrrolidineprimary alcoholtertiary amineorganoheterocyclic compoundproline or derivativesalcoholazacyclen-alkylpyrrolidinetertiary aliphatic amineoxacyclemonocarboxylic acid or derivativespyrrolidine carboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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