| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:57 UTC |
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| Update Date | 2025-03-21 18:36:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00112626 |
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| Frequency | 23.6 |
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| Structure | |
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| Chemical Formula | C11H14O2 |
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| Molecular Mass | 178.0994 |
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| SMILES | CC(C)(O)Cc1ccc(C=O)cc1 |
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| InChI Key | CCTLGNIXCABCCS-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 | benzaldehydesbenzoyl derivativeshydrocarbon derivativesorganic oxidestertiary alcohols |
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| Substituents | alcoholbenzoylaldehydephenylpropanearomatic homomonocyclic compoundbenzaldehydetertiary alcoholorganic oxidearyl-aldehydeorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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