| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:48 UTC |
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| Update Date | 2025-03-21 18:06:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00064059 |
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| Frequency | 48.1 |
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| Structure | |
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| Chemical Formula | C9H14N4O4S |
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| Molecular Mass | 274.0736 |
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| SMILES | CSCC1OC(n2cnc(N)nc2=O)C(O)C1O |
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| InChI Key | AGAZHRMNTYGWIU-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 | triazines |
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| Subclass | aminotriazines |
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| Direct Parent | aminotriazines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diolsazacyclic compoundsdialkylthioethershalo-s-triazinesheteroaromatic compoundshydrocarbon derivativesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary aminessecondary alcoholssulfenyl compoundstetrahydrofuranstriazinones |
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| Substituents | amino-1,3,5-triazinearomatic heteromonocyclic compoundmonosaccharideorganosulfur compoundsaccharideorganic oxideorganonitrogen compoundorganopnictogen compound1,2-diolalcoholcarbonic acid derivativesulfenyl compoundazacycletetrahydrofurandialkylthioetheraminotriazineheteroaromatic compoundoxacycleorganic oxygen compoundthioetherhalo-s-triazinesecondary alcoholhydrocarbon derivative1,3,5-triazineprimary amineorganic nitrogen compoundaminetriazinoneorganooxygen compound |
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