| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:13 UTC |
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| Update Date | 2025-03-25 00:54:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02208648 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H17NO2 |
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| Molecular Mass | 207.1259 |
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| SMILES | CC(=O)OCc1ccccc1CN(C)C |
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| InChI Key | TXWITYVYVQEQSQ-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 | benzyloxycarbonyls |
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| Direct Parent | benzyloxycarbonyls |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | amino acids and derivativesaralkylaminesbenzylaminescarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsphenylmethylaminestrialkylamines |
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| Substituents | benzyloxycarbonylcarbonyl groupamino acid or derivativestertiary aliphatic aminecarboxylic acid derivativearalkylaminearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesphenylmethylamineorganic oxygen compoundbenzylaminecarboxylic acid esterorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganooxygen compound |
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