| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:09:24 UTC |
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| Update Date | 2025-03-21 19:05:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00226003 |
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| Frequency | 9.5 |
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| Structure | |
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| Chemical Formula | C4H7N3OS |
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| Molecular Mass | 145.031 |
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| SMILES | NC(=O)C1CSC(N)=N1 |
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| InChI Key | YSJMWRFLTYMNRB-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acids and derivativeshydrocarbon derivativesisothioureasorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidespropargyl-type 1,3-dipolar organic compoundsthiazolecarboxamidesthiazolesthiazolines |
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| Substituents | primary carboxylic acid amidecarbonyl groupmeta-thiazolineazacycleorganic 1,3-dipolar compoundcarboximidamidecarboxamide grouppropargyl-type 1,3-dipolar organic compoundorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundthiazolecarboxamidethiazoleorganoheterocyclic compoundorganooxygen compoundisothiourea |
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