| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-21 00:24:10 UTC |
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| Update Date | 2025-03-21 18:38:21 UTC |
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| HMDB ID | HMDB0032936 |
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| Metabolite Identification |
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| DeepMet ID | DMID00120373 |
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| Name | 4-Chloro-1H-indole-3-acetic acid |
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| Frequency | 21.6 |
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| Structure | |
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| Chemical Formula | C10H8ClNO2 |
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| Molecular Mass | 209.0244 |
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| SMILES | O=C(O)Cc1c[nH]c2cccc(Cl)c12 |
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| InChI Key | WNCFBCKZRJDRKZ-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 | aryl chloridesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | aryl chloridecarbonyl groupcarboxylic acidazacycleindoleorganochlorideheteroaromatic compoundcarboxylic acid derivativeorganohalogen compoundaryl halideorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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