| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:46 UTC |
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| Update Date | 2025-03-25 00:54:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02205293 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H13NOS |
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| Molecular Mass | 171.0718 |
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| SMILES | NCC(CO)Cc1cccs1 |
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| InChI Key | CGPMMCUNQQDJFP-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | hydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundsprimary alcoholsthiophenes |
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| Substituents | alcoholaromatic heteromonocyclic compoundheteroaromatic compoundthiopheneorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundprimary alcoholorganooxygen compound |
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