Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:45:33 UTC |
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Update Date | 2025-03-25 00:48:27 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02168286 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C19H20O3 |
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Molecular Mass | 296.1412 |
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SMILES | CC(CCCC(=O)O)c1cccc(C(=O)c2ccccc2)c1 |
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InChI Key | JAEVIGNTBDIFEZ-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 | benzophenones |
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Direct Parent | benzophenones |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | aryl ketonesaryl-phenylketonesbenzoyl derivativescarbocyclic fatty acidscarboxylic acidsdiphenylmethaneshydrocarbon derivativesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxides |
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Substituents | fatty acyldiphenylmethanecarbocyclic fatty acidcarbonyl groupcarboxylic acidaryl-phenylketonebenzoylfatty acidcarboxylic acid derivativebenzophenoneketonearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativemedium-chain fatty acidorganooxygen compoundaryl ketone |
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