| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:27 UTC |
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| Update Date | 2025-03-25 00:54:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02206835 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H21NO6 |
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| Molecular Mass | 359.1369 |
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| SMILES | O=C(NC(Cc1ccccc1)C(O)C(O)C(=O)O)OCc1ccccc1 |
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| InChI Key | HEDBUOAIINMLPX-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 | gamma amino acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1,2-diolsalpha hydroxy acids and derivativesamino fatty acidsamphetamines and derivativesbenzyloxycarbonylsbeta hydroxy acids and derivativescarbamate esterscarbocyclic fatty acidscarbonyl compoundscarboxylic acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary alcohols |
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| Substituents | benzyloxycarbonylfatty acylcarbocyclic fatty acidmonocyclic benzene moietycarbonyl groupcarboxylic acidgamma amino acid or derivativesalpha-hydroxy acidmonosaccharidefatty acidmedium-chain hydroxy acidbeta-hydroxy acidsaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acidamphetamine or derivatives1,2-diolalcoholcarbonic acid derivativecarbamic acid esterhydroxy acidamino fatty acidaromatic homomonocyclic compoundmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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