| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:07 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 | DMID02220131 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H17N3OS2 |
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| Molecular Mass | 271.0813 |
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| SMILES | CS(=O)CCCCNC(=S)Nc1ccccn1 |
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| InChI Key | NWLNCGRVDFAWTQ-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 | pyridines and derivatives |
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| Subclass | methylpyridines |
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| Direct Parent | methylpyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsorganic oxidesorganonitrogen compoundsorganopnictogen compoundssulfinyl compoundssulfoxidesthioureas |
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| Substituents | thioureaaromatic heteromonocyclic compoundazacycleheteroaromatic compoundmethylpyridineorganosulfur compoundorganic oxideorganic oxygen compoundsulfinyl compoundorganonitrogen compoundsulfoxideorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundimidolactam |
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