| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:36:59 UTC |
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| Update Date | 2025-03-21 17:57:31 UTC |
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| HMDB ID | HMDB0059963 |
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| Metabolite Identification |
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| DeepMet ID | DMID00008421 |
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| Name | 1,3,5-Trimethoxybenzene |
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| Frequency | 582.0 |
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| Structure | |
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| Chemical Formula | C9H12O3 |
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| Molecular Mass | 168.0786 |
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| SMILES | COc1cc(OC)cc(OC)c1 |
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| InChI Key | LKUDPHPHKOZXCD-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 | phenol ethers |
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| Subclass | anisoles |
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| Direct Parent | anisoles |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl aryl ethershydrocarbon derivativesmethoxybenzenesphenoxy compounds |
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| Substituents | monocyclic benzene moietyetheralkyl aryl ethermethoxybenzenearomatic homomonocyclic compoundorganic oxygen compoundanisolehydrocarbon derivativephenoxy compoundorganooxygen compound |
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