| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:06 UTC |
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| Update Date | 2025-03-25 00:48:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02169506 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H21NOS |
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| Molecular Mass | 275.1344 |
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| SMILES | CCCN(CCC)S(=O)c1cccc2ccccc12 |
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| InChI Key | MREDJUIHMYEXDK-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 | naphthalenes |
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| Direct Parent | naphthalenes |
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| Geometric Descriptor | aromatic homopolycyclic compounds |
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| Alternative Parents | aminosulfinyl compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfinic acids and derivatives |
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| Substituents | sulfinic acid derivativearomatic homopolycyclic compoundorganosulfur compoundaminosulfinyl compoundorganic oxidenaphthaleneorganic oxygen compoundsulfinyl compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compound |
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