| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:35:22 UTC |
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| Update Date | 2025-03-21 17:56:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00004731 |
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| Frequency | 1169.2 |
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| Structure | |
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| Chemical Formula | C9H12O |
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| Molecular Mass | 136.0888 |
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| SMILES | CC(C)(O)c1ccccc1 |
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| InChI Key | BDCFWIDZNLCTMF-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 | phenylpropanes |
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| Direct Parent | phenylpropanes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aromatic alcoholshydrocarbon derivativestertiary alcohols |
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| Substituents | aromatic alcoholphenylpropanealcoholaromatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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