| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:42 UTC |
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| Update Date | 2025-03-21 18:03:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00045064 |
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| Frequency | 74.9 |
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| Structure | |
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| Chemical Formula | C10H13NO7P2 |
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| Molecular Mass | 321.0167 |
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| SMILES | O=P(O)(O)OP(=O)(O)OCCc1c[nH]c2ccccc12 |
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| InChI Key | NYPNWZVWKPRDGH-UHFFFAOYSA-N |
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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 | organic oxoanionic compounds |
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| Subclass | organic pyrophosphates |
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| Direct Parent | organic pyrophosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesmonoalkyl phosphatesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrroles |
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| Substituents | azacycleindoleheteroaromatic compoundindole or derivativesorganic pyrophosphateorganic oxidephosphoric acid esteraromatic heteropolycyclic compoundmonoalkyl phosphatepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganoheterocyclic compoundorganooxygen compound |
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