| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:23 UTC |
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| Update Date | 2025-03-25 00:55:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02211448 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H11N3O2 |
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| Molecular Mass | 217.0851 |
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| SMILES | CC(=O)Nc1c(C(N)=O)[nH]c2ccccc12 |
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| InChI Key | CWWWPFBJWHNWNJ-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 | indolecarboxylic acids and derivatives |
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| Direct Parent | indolecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-heteroaryl carboxamidesacetamidesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesn-acetylarylaminesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespyrrole carboxamidessecondary carboxylic acid amidesvinylogous amides |
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| Substituents | primary carboxylic acid amidecarbonyl groupn-acetylarylamineindolen-arylamidecarboxylic acid derivative2-heteroaryl carboxamideorganic oxidepyrrole-2-carboxylic acid or derivativesaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundpyrrole-2-carboxamideacetamideindolecarboxylic acid derivativevinylogous amideazacycleheteroaromatic compoundcarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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