| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:25 UTC |
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| Update Date | 2025-03-25 01:01:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252615 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H17N3O9P+ |
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| Molecular Mass | 366.0697 |
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| SMILES | NC(=O)c1c[n+](C2OC(COP(=O)(O)O)C(O)C(O)C2O)ccn1 |
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| InChI Key | ATDHYEFWNWIRHC-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 | hexose phosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-heteroaryl carboxamidesazacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesmonoalkyl phosphatesmonosaccharidesorganic cationsorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary carboxylic acid amidespyrazinecarboxamidessecondary alcoholsvinylogous amides |
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| Substituents | primary carboxylic acid amidearomatic heteromonocyclic compoundcarboxylic acid derivative2-heteroaryl carboxamideorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationoxaneorganoheterocyclic compoundalcoholpyrazinecarboxamidevinylogous amideazacycleheteroaromatic compoundcarboxamide groupoxacyclephosphoric acid esterpyrazinemonoalkyl phosphatesecondary alcoholhexose phosphatepyrazine carboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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