| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:38:30 UTC |
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| Update Date | 2025-03-21 17:58:04 UTC |
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| HMDB ID | HMDB0240623 |
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| Metabolite Identification |
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| DeepMet ID | DMID00011990 |
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| Name | Methyl indole-3-propanoate |
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| Frequency | 382.0 |
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| Structure | |
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| Chemical Formula | C12H13NO2 |
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| Molecular Mass | 203.0946 |
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| SMILES | COC(=O)CCc1c[nH]c2ccccc12 |
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| InChI Key | BAYIDMGOQRXHBC-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 | azacyclic compoundsbenzenoidscarbonyl compoundsfatty acid estersheteroaromatic compoundshydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | fatty acylcarbonyl groupazacycleindoleheteroaromatic compoundcarboxylic acid derivativefatty acid esterorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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