| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:40 UTC |
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| Update Date | 2025-03-25 00:52:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02193592 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C18H21NO5S |
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| Molecular Mass | 363.114 |
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| SMILES | CN(C)C1Cc2ccc(OS(=O)(=O)O)cc2CC1c1ccc(O)cc1 |
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| InChI Key | JPMMPOXWMWPUNB-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 | naphthalenes |
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| Subclass | phenylnaphthalenes |
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| Direct Parent | phenylnaphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsarylsulfatesbenzene and substituted derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundssulfuric acid monoesterstetralinstrialkylamines |
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| Substituents | tetralinmonocyclic benzene moietysulfuric acid monoesterorganic sulfuric acid or derivativestertiary aliphatic amine1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compoundorganic oxideorganic oxygen compoundphenylnaphthaleneorganonitrogen compoundorganopnictogen compoundsulfate-esterphenolhydrocarbon derivativearylsulfateorganic nitrogen compoundsulfuric acid esteraminetertiary amineorganooxygen compound |
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