| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:08 UTC |
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| Update Date | 2025-03-25 00:56:42 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220181 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H13NO3S |
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| Molecular Mass | 191.0616 |
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| SMILES | CSC1=NCC(C(O)C(C)O)O1 |
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| InChI Key | NBEPZSXXOBOXIB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | azolines |
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| Subclass | oxazolines |
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| Direct Parent | oxazolines |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsazacyclic compoundshydrocarbon derivativesmonothioacetalsorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspropargyl-type 1,3-dipolar organic compoundssecondary alcoholssulfenyl compounds |
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| Substituents | alcoholsulfenyl compoundazacycleorganic 1,3-dipolar compoundorganosulfur compoundpropargyl-type 1,3-dipolar organic compoundmonothioacetaloxacycleoxazolineorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound1,2-diol |
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