| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:34 UTC |
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| Update Date | 2025-03-25 00:53:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02202520 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H11NO3 |
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| Molecular Mass | 253.0739 |
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| SMILES | O=C(O)c1ccc(Oc2ccc3cc[nH]c3c2)cc1 |
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| InChI Key | ZFNRNODFOWBYPC-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 compoundsbenzoic acidsbenzoyl derivativescarboxylic acidsheteroaromatic compoundshydrocarbon derivativesindolesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenol ethersphenoxy compoundspyrroles |
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| Substituents | diaryl etherphenol ethermonocyclic benzene moietycarboxylic acidindolebenzoylcarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundbenzoic acidorganoheterocyclic compoundazacycleheteroaromatic compoundindole or derivativesbenzoic acid or derivativesmonocarboxylic acid or derivativespyrrolehydrocarbon derivativebenzenoidorganic nitrogen compoundphenoxy compound |
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