| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:03:50 UTC |
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| Update Date | 2025-03-21 18:28:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00071324 |
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| Frequency | 42.1 |
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| Structure | |
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| Chemical Formula | C17H22N2O4 |
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| Molecular Mass | 318.158 |
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| SMILES | CC(=O)N1CCN(c2ccc(OCC3CCC(=O)O3)cc2)CC1 |
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| InChI Key | XIZZXMKEAZZRFV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | diazinanes |
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| Subclass | piperazines |
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| Direct Parent | phenylpiperazines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesalkyl aryl ethersamino acids and derivativesaminophenyl ethersaniline and substituted anilinesazacyclic compoundscarbonyl compoundscarboxylic acid estersdialkylarylaminesgamma butyrolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesn-arylpiperazinesorganic oxidesorganopnictogen compoundsoxacyclic compoundsphenoxy compoundstertiary carboxylic acid amidestetrahydrofurans |
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| Substituents | phenol ethermonocyclic benzene moietycarbonyl groupetheraromatic heteromonocyclic compoundamino acid or derivativesalkyl aryl ethercarboxylic acid derivativelactoneorganic oxidetertiary aliphatic/aromatic aminetertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compounddialkylarylamineaminophenyl ethertertiary amineacetamideazacycletetrahydrofurananiline or substituted anilinescarboxamide groupgamma butyrolactonephenylpiperazineoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compoundaminen-arylpiperazineorganooxygen compound |
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