| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:02 UTC |
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| Update Date | 2025-03-21 18:03:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00045857 |
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| Frequency | 73.3 |
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| Structure | |
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| Chemical Formula | C14H12O5 |
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| Molecular Mass | 260.0685 |
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| SMILES | COc1cc(C(=O)c2ccc(O)cc2O)ccc1O |
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| InChI Key | JJUWGDUVBOIOKW-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 | benzophenones |
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| Direct Parent | benzophenones |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsalkyl aryl ethersanisolesaryl ketonesaryl-phenylketonesbenzoyl derivativesdiphenylmethaneshydrocarbon derivativesmethoxybenzenesmethoxyphenolsorganic oxidesphenoxy compoundsresorcinolsvinylogous acids |
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| Substituents | diphenylmethanephenol etheretherbenzoyl1-hydroxy-2-unsubstituted benzenoidmethoxyphenolalkyl aryl etherresorcinolbenzophenoneketoneorganic oxidearyl-phenylketone1-hydroxy-4-unsubstituted benzenoidmethoxybenzenearomatic homomonocyclic compoundvinylogous acidorganic oxygen compoundanisolephenolhydrocarbon derivativephenoxy compoundorganooxygen compoundaryl ketone |
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