| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:44:10 UTC |
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| Update Date | 2025-03-21 18:00:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00024697 |
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| Frequency | 157.5 |
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| Structure | |
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| Chemical Formula | C13H14N2O2 |
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| Molecular Mass | 230.1055 |
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| SMILES | CC(=O)NCCC(=O)c1c[nH]c2ccccc12 |
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| InChI Key | LZKMRHIMCLFHQD-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 | indoles and derivatives |
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| Subclass | indoles |
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| Direct Parent | indoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetamidesaryl alkyl ketonesazacyclic compoundsbenzenoidscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | carbonyl grouparyl alkyl ketoneindolecarboxylic acid derivativeketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundacetamidevinylogous amideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundaryl ketone |
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