| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:38:04 UTC |
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| Update Date | 2025-03-21 17:57:55 UTC |
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| HMDB ID | HMDB0029867 |
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| Metabolite Identification |
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| DeepMet ID | DMID00011006 |
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| Name | Isoelemicin |
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| Frequency | 423.4 |
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| Structure | |
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| Chemical Formula | C12H16O3 |
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| Molecular Mass | 208.1099 |
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| SMILES | CC=Cc1cc(OC)c(OC)c(OC)c1 |
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| InChI Key | RRXOQHQFJOQLQR-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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