| Record Information |
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| HMDB Status | quantified |
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| Creation Date | 2024-02-20 23:42:18 UTC |
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| Update Date | 2025-03-21 17:59:21 UTC |
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| HMDB ID | HMDB0032133 |
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| Metabolite Identification |
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| DeepMet ID | DMID00020449 |
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| Name | Bisphenol A |
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| Frequency | 198.0 |
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| Structure | |
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| Chemical Formula | C15H16O2 |
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| Molecular Mass | 228.115 |
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| SMILES | CC(C)(c1ccc(O)cc1)c1ccc(O)cc1 |
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| InChI Key | IISBACLAFKSPIT-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 | diphenylmethanes |
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| Direct Parent | bisphenols |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidshydrocarbon derivativesorganooxygen compoundsphenylpropanes |
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| Substituents | phenylpropanearomatic homomonocyclic compoundorganic oxygen compound1-hydroxy-2-unsubstituted benzenoidphenolhydrocarbon derivativebisphenolorganooxygen compound |
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