Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:42:50 UTC |
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Update Date | 2025-03-25 00:47:29 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02162057 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C17H15NO5 |
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Molecular Mass | 313.095 |
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SMILES | O=C(O)C1CC(c2ccc(O)cc2)(c2cccc(O)c2)C(O)=N1 |
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InChI Key | QMJNAFLGHLELPM-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | diphenylmethanes |
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Direct Parent | diphenylmethanes |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidscyclic carboximidic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsphenylpyrrolinespropargyl-type 1,3-dipolar organic compoundspyrrolespyrroline 2-carboxylic acids |
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Substituents | diphenylmethanecarbonyl groupcarboxylic acidaromatic heteromonocyclic compound3-phenylpyrroline1-hydroxy-2-unsubstituted benzenoidalpha-amino acid or derivativescarboxylic acid derivativepropargyl-type 1,3-dipolar organic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazacyclepyrroline carboxylic acid or derivativesorganic 1,3-dipolar compound1-hydroxy-4-unsubstituted benzenoidpyrroline 2-carboxylic acidmonocarboxylic acid or derivativespyrrolineorganic oxygen compoundpyrroline carboxylic acidpyrrolephenolhydrocarbon derivativeorganic nitrogen compoundcyclic carboximidic acidorganooxygen compound |
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