| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:41 UTC |
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| Update Date | 2025-03-25 00:57:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02223769 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H16N3O8P |
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| Molecular Mass | 325.0675 |
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| SMILES | NC(=O)c1cnn(CC(O)C(O)C(O)COP(=O)(O)O)c1 |
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| InChI Key | GXEJFKLGMYQLEV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic phosphoric acids and derivatives |
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| Subclass | phosphate esters |
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| Direct Parent | monoalkyl phosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidespyrazolessecondary alcoholsvinylogous amides |
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| Substituents | primary carboxylic acid amidealcoholvinylogous amidearomatic heteromonocyclic compoundazacycleheteroaromatic compoundcarboxamide groupcarboxylic acid derivativepyrazoleorganic oxideorganic oxygen compoundmonoalkyl phosphateorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundazole |
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