| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:18 UTC |
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| Update Date | 2025-03-25 00:53:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02201942 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H23N3O2S |
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| Molecular Mass | 297.1511 |
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| SMILES | CSCCC(N)C(O)=NC(O)C(N)Cc1ccccc1 |
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| InChI Key | XKTWZTQRMXTBMN-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 | phenethylamines |
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| Direct Parent | amphetamines and derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkanolaminesbenzene and substituted derivativescarboximidic acidsdialkylthioethershydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundssulfenyl compounds |
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| Substituents | carboximidic acidsulfenyl compounddialkylthioetherorganic 1,3-dipolar compoundorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundaromatic homomonocyclic compoundorganic oxygen compoundthioetherorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamphetamine or derivativesalkanolamine |
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