| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:13 UTC |
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| Update Date | 2025-03-25 00:56:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220365 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H12N4S |
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| Molecular Mass | 208.0783 |
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| SMILES | CSCCNc1ncnc2cc[nH]c12 |
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| InChI Key | GLIPMSIYBSIXPE-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 | pyrrolopyrimidines |
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| Subclass | pyrrolopyrimidines |
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| Direct Parent | pyrrolopyrimidines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkylthioethersheteroaromatic compoundshydrocarbon derivativesimidolactamsorganopnictogen compoundspyrimidines and pyrimidine derivativespyrrolessecondary alkylarylaminessulfenyl compounds |
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| Substituents | sulfenyl compoundazacycledialkylthioetherheteroaromatic compoundsecondary amineorganosulfur compoundsecondary aliphatic/aromatic aminepyrimidinepyrrolopyrimidinearomatic heteropolycyclic compoundthioetherpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundimidolactamamine |
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