| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:55 UTC |
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| Update Date | 2025-03-21 18:34:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00100283 |
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| Frequency | 27.3 |
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| Structure | |
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| Chemical Formula | C10H15N3O8P+ |
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| Molecular Mass | 336.0591 |
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| SMILES | NC(=O)c1c[n+](C2OC(COP(=O)(O)O)C(O)C2O)ccn1 |
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| InChI Key | XRCDCXHUOBBVBB-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | pentose phosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,2-diols2-heteroaryl carboxamidesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmonoalkyl phosphatesmonosaccharidesorganic cationsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary carboxylic acid amidespyrazinecarboxamidessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | primary carboxylic acid amidearomatic heteromonocyclic compoundpentose phosphatepentose-5-phosphatecarboxylic acid derivative2-heteroaryl carboxamideorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganoheterocyclic compound1,2-diolalcoholpyrazinecarboxamidevinylogous amideazacycletetrahydrofuranheteroaromatic compoundcarboxamide groupoxacyclephosphoric acid esterpyrazinemonoalkyl phosphatesecondary alcoholpyrazine carboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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