| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:06:13 UTC |
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| Update Date | 2025-03-25 00:56:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02215684 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H24O6 |
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| Molecular Mass | 312.1573 |
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| SMILES | CCCC(O)CCC(O)COC(=O)c1ccc(O)c(OC)c1 |
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| InChI Key | BAIJDSNZTGRNMS-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 | benzoic acids and derivatives |
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| Direct Parent | m-methoxybenzoic acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersanisolesbenzoyl derivativescarboxylic acid estersfatty alcoholshydrocarbon derivativesmethoxybenzenesmethoxyphenolsmonocarboxylic acids and derivativesorganic oxidesphenoxy compoundssecondary alcoholsp-hydroxybenzoic acid alkyl esters |
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| Substituents | fatty acylphenol etheretherp-hydroxybenzoic acid esterbenzoyl1-hydroxy-2-unsubstituted benzenoidmethoxyphenolbenzoate esteralkyl aryl ethercarboxylic acid derivativeorganic oxidefatty alcoholm-methoxybenzoic acid or derivativesalcoholmethoxybenzenep-hydroxybenzoic acid alkyl esteraromatic homomonocyclic compoundmonocarboxylic acid or derivativesorganic oxygen compoundanisolecarboxylic acid estersecondary alcoholphenolhydrocarbon derivativephenoxy compoundorganooxygen compound |
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