Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:37:27 UTC |
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Update Date | 2025-03-21 17:57:42 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00009555 |
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Frequency | 503.3 |
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Structure | |
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Chemical Formula | C11H15NO3 |
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Molecular Mass | 209.1052 |
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SMILES | CN(C)CCOC(=O)c1ccccc1O |
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InChI Key | YXXHHRXVBMWBLC-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | benzoic acids and derivatives |
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Direct Parent | o-hydroxybenzoic acid esters |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsamino acids and derivativesbenzoyl derivativescarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundssalicylic acid and derivativestrialkylaminesvinylogous acids |
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Substituents | amino acid or derivativesbenzoyl1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundtertiary aminetertiary aliphatic amine1-hydroxy-4-unsubstituted benzenoidaromatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundsalicylic acid or derivativeso-hydroxybenzoic acid estercarboxylic acid esterphenolhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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