| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:17:33 UTC |
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| Update Date | 2025-03-21 18:35:10 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00104354 |
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| Frequency | 26.0 |
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| Structure | |
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| Chemical Formula | C12H21N3O2S |
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| Molecular Mass | 271.1354 |
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| SMILES | CNC(=O)NCCSCc1ccc(CN(C)C)o1 |
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| InChI Key | NRBJTCXMARKNCT-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | aralkylamines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | carbonyl compoundsdialkylthioethersfuransheteroaromatic compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundssulfenyl compoundstrialkylamines |
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| Substituents | furancarbonyl groupcarbonic acid derivativesulfenyl compoundaromatic heteromonocyclic compounddialkylthioetherheteroaromatic compoundtertiary aliphatic amineorganosulfur compoundaralkylamineoxacycleorganic oxideorganic oxygen compoundthioetherorganopnictogen compoundhydrocarbon derivativetertiary amineorganoheterocyclic compoundorganooxygen compound |
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