| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:56:57 UTC |
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| Update Date | 2025-03-25 00:52:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02194244 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H24N2O3S |
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| Molecular Mass | 288.1508 |
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| SMILES | CN(C)Cc1ccc(CSCCNCC(O)CO)o1 |
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| InChI Key | NYWMZUONGLAAQZ-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 | 1,2-diolsdialkylaminesdialkylthioethersfuransheteroaromatic compoundshydrocarbon derivativesorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholssulfenyl compoundstrialkylamines |
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| Substituents | furanaromatic heteromonocyclic compoundorganosulfur compoundaralkylamineorganopnictogen compoundprimary alcoholtertiary amineorganoheterocyclic compound1,2-diolalcoholsecondary aliphatic aminesulfenyl compounddialkylthioetherheteroaromatic compoundtertiary aliphatic aminesecondary amineoxacycleorganic oxygen compoundthioethersecondary alcoholhydrocarbon derivativeorganooxygen compound |
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