Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:50:26 UTC |
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Update Date | 2025-03-25 00:50:13 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02179480 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H14O5 |
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Molecular Mass | 262.0841 |
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SMILES | COc1ccc2cc(C(CO)C(=O)O)ccc2c1O |
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InChI Key | OJOGEFPHLDKBSC-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 | naphthols and derivatives |
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Direct Parent | naphthols and derivatives |
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Geometric Descriptor | aromatic homopolycyclic compounds |
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Alternative Parents | 1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesprimary alcohols |
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Substituents | alcoholphenol ethercarbonyl groupethercarboxylic acidaromatic homopolycyclic compoundhydroxy acid1-hydroxy-4-unsubstituted benzenoidalkyl aryl ethercarboxylic acid derivativebeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundanisolehydrocarbon derivative1-naphtholprimary alcoholorganooxygen compound |
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