| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:52 UTC |
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| Update Date | 2025-03-25 00:57:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02224177 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H5N3O2S |
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| Molecular Mass | 195.0102 |
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| SMILES | Nc1ncnc2scc(C(=O)O)c12 |
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| InChI Key | GFDCBZZRXIQMDS-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 | thienopyrimidines |
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| Subclass | thienopyrimidines |
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| Direct Parent | thienopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compoundsamino acidsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonocarboxylic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivativesthiophene carboxylic acids |
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| Substituents | carboxylic acidamino acid or derivativesamino acidthiophene carboxylic acidthiophenecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound1-carboxy-2-haloaromatic compoundimidolactamthienopyrimidineazacycleheteroaromatic compoundthiophene carboxylic acid or derivativesmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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