| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-20 23:42:57 UTC |
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| Update Date | 2025-03-21 17:59:35 UTC |
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| HMDB ID | HMDB0032039 |
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| Metabolite Identification |
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| DeepMet ID | DMID00021925 |
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| Name | Benzoin |
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| Frequency | 181.5 |
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| Structure | |
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| Chemical Formula | C14H12O2 |
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| Molecular Mass | 212.0837 |
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| SMILES | O=C(c1ccccc1)C(O)c1ccccc1 |
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| InChI Key | ISAOCJYIOMOJEB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | phenylpropanoids and polyketides |
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| Class | stilbenes |
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| Subclass | benzoins |
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| Direct Parent | benzoins |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acyloinsalkyl-phenylketonesaromatic alcoholsaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidessecondary alcohols |
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| Substituents | aromatic alcoholalcoholmonocyclic benzene moietyaryl alkyl ketonebenzoinbenzoylphenylketoneketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundacyloinsecondary alcoholhydrocarbon derivativebenzenoidalkyl-phenylketoneorganooxygen compoundaryl ketone |
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