| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:08 UTC |
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| Update Date | 2025-03-25 00:55:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02210839 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H9ClO2 |
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| Molecular Mass | 196.0291 |
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| SMILES | CC(=CC(=O)O)c1ccc(Cl)cc1 |
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| InChI Key | SINDTVUVNPIJMY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | cinnamic acids and derivatives |
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| Subclass | cinnamic acids and derivatives |
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| Direct Parent | cinnamic acids and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chloridescarbonyl compoundscarboxylic acidschlorobenzeneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesphenylpropenes |
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| Substituents | aryl chloridechlorobenzenemonocyclic benzene moietycarbonyl groupcarboxylic acidorganochloridecarboxylic acid derivativeorganohalogen compoundaryl halidearomatic homomonocyclic compoundcinnamic acid or derivativesorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundphenylpropenehydrocarbon derivativebenzenoidhalobenzeneorganooxygen compound |
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