Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:44:25 UTC |
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Update Date | 2025-03-21 18:00:07 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00025297 |
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Frequency | 152.7 |
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Structure | |
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Chemical Formula | C10H14O2 |
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Molecular Mass | 166.0994 |
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SMILES | CC(C)(O)C(O)c1ccccc1 |
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InChI Key | UPFQJMVQJWHPOL-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 | 1,2-diolsaromatic alcoholshydrocarbon derivativessecondary alcoholstertiary alcohols |
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Substituents | aromatic alcoholalcoholphenylpropanearomatic homomonocyclic compoundtertiary alcoholorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound1,2-diol |
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