| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:50:22 UTC |
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| Update Date | 2025-03-25 00:50:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02179339 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H13N7S |
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| Molecular Mass | 251.0953 |
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| SMILES | CSCCNc1nc(N)c2ncnc(N)c2n1 |
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| InChI Key | JNKHKUSOOOHFSJ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | amines |
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| Direct Parent | secondary alkylarylamines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylthioethersheteroaromatic compoundshydrocarbon derivativesimidolactamsorganopnictogen compoundsprimary aminespyrimidines and pyrimidine derivativessulfenyl compounds |
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| Substituents | sulfenyl compoundazacycledialkylthioetherheteroaromatic compoundorganosulfur compoundsecondary aliphatic/aromatic aminepyrimidinearomatic heteropolycyclic compoundthioetherorganopnictogen compoundhydrocarbon derivativeprimary amineimidolactamorganoheterocyclic compound |
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