| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:55 UTC |
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| Update Date | 2025-03-25 00:50:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182871 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H12N3O5+ |
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| Molecular Mass | 230.0771 |
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| SMILES | O=c1[nH]c[n+](C2CC(O)C(CO)O2)c(=O)[nH]1 |
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| InChI Key | QVHBBRWEQLPGLD-UHFFFAOYSA-O |
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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 | triazinones |
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| Direct Parent | triazinones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,3,5-triazinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonosaccharidesorganic carbonic acids and derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | alcoholcarbonic acid derivativearomatic heteromonocyclic compoundazacycletetrahydrofuranheteroaromatic compoundmonosaccharideoxacyclesaccharideorganic oxideorganic oxygen compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivative1,3,5-triazineorganic nitrogen compoundorganic cationprimary alcoholtriazinoneorganooxygen compound |
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