Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:41:07 UTC |
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Update Date | 2025-03-25 00:46:55 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02158256 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C13H10O5 |
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Molecular Mass | 246.0528 |
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SMILES | O=C(O)COc1cccc2ccc(C(=O)O)cc12 |
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InChI Key | UWBPMVGVFVXSFJ-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 | naphthalenes |
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Subclass | naphthalenecarboxylic acids and derivatives |
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Direct Parent | naphthalenecarboxylic acids |
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Geometric Descriptor | aromatic homopolycyclic compounds |
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Alternative Parents | alkyl aryl etherscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesphenol ethersphenoxyacetic acid derivatives |
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Substituents | phenol etherphenoxyacetatecarbonyl groupethercarboxylic acidaromatic homopolycyclic compoundalkyl aryl ethercarboxylic acid derivativeorganic oxideorganic oxygen compounddicarboxylic acid or derivativeshydrocarbon derivative2-naphthalenecarboxylic acidorganooxygen compound |
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