| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:31:22 UTC |
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| Update Date | 2025-03-21 18:42:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00137211 |
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| Frequency | 18.2 |
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| Structure | |
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| Chemical Formula | C14H15NO5 |
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| Molecular Mass | 277.095 |
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| SMILES | COc1ccc2[nH]c(CCC(=O)O)c(CC(=O)O)c2c1 |
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| InChI Key | KLARREZVKNOFBE-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 | alkyl aryl ethersanisolesazacyclic compoundscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrroles |
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| Substituents | phenol ethercarbonyl groupethercarboxylic acidazacycleindoleheteroaromatic compoundalkyl aryl ethercarboxylic acid derivativeorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundanisolepyrroleorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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