| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:02 UTC |
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| Update Date | 2025-03-21 18:02:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00040990 |
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| Frequency | 84.0 |
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| Structure | |
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| Chemical Formula | C14H18NO9P |
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| Molecular Mass | 375.0719 |
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| SMILES | O=P(O)(O)OCC1OC(Oc2c[nH]c3ccccc23)C(O)C(O)C1O |
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| InChI Key | BTTMXAFKEXOXRT-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 | 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 heteropolycyclic compounds |
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| Alternative Parents | acetalsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesmonoalkyl phosphatesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanespyrrolessecondary alcohols |
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| Substituents | indoleorganic oxideacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneorganoheterocyclic compoundalcoholazacycleheteroaromatic compoundindole or derivativesoxacyclephosphoric acid estermonoalkyl phosphatepyrrolesecondary alcoholhexose phosphatehydrocarbon derivativebenzenoidorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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