| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:19:12 UTC |
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| Update Date | 2025-03-25 01:00:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02245239 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C25H30N4O3 |
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| Molecular Mass | 434.2318 |
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| SMILES | CN1CCC(CNc2ccc(C(=O)NC(Cc3c[nH]c4ccccc34)C(=O)O)cc2)CC1 |
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| InChI Key | GCVSXFPIIBTUEP-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 | hippuric acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundsbenzoyl derivativescarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesindolesmonocarboxylic acids and derivativesn-acyl-alpha amino acidsorganic oxidesorganopnictogen compoundsphenylalkylaminespiperidinespyrrolessecondary alkylarylaminessecondary carboxylic acid amidestrialkylamines |
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| Substituents | carbonyl groupcarboxylic acidamino acid or derivativesamino acidindolebenzoylalpha-amino acid or derivativescarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundpiperidinetertiary amineorganoheterocyclic compoundn-acyl-alpha amino acid or derivativesazacyclen-acyl-alpha-amino acidhippuric acid or derivativesheteroaromatic compoundtertiary aliphatic amineindole or derivativessecondary aminecarboxamide groupsecondary aliphatic/aromatic aminesecondary carboxylic acid amidemonocarboxylic acid or derivativesorganic oxygen compoundpyrrolephenylalkylaminehydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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