| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:16:55 UTC |
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| Update Date | 2025-03-25 00:59:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02239910 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C19H17NO3 |
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| Molecular Mass | 307.1208 |
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| SMILES | O=C1CCC(Cc2ccc(Oc3c[nH]c4ccccc34)cc2)O1 |
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| InChI Key | IPDMEJUIXCKLMC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | ethers |
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| Direct Parent | diarylethers |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acid estersgamma butyrolactonesheteroaromatic compoundshydrocarbon derivativesindolesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsphenol ethersphenoxy compoundspyrrolestetrahydrofurans |
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| Substituents | diaryl etherphenol ethermonocyclic benzene moietycarbonyl groupindolecarboxylic acid derivativelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazacycletetrahydrofuranheteroaromatic compoundindole or derivativesgamma butyrolactoneoxacyclemonocarboxylic acid or derivativescarboxylic acid esterpyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compound |
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