| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:35 UTC |
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| Update Date | 2025-03-21 18:29:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077999 |
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| Frequency | 37.6 |
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| Structure | |
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| Chemical Formula | C12H15N2O5P |
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| Molecular Mass | 298.0719 |
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| SMILES | CC(=O)NCCc1c[nH]c2ccc(OP(=O)(O)O)cc12 |
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| InChI Key | BJNWOJAGSADFFZ-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 | aryl phosphomonoesters |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetamidesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesindolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspyrrolessecondary carboxylic acid amides |
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| Substituents | carbonyl groupindolecarboxylic acid derivativeorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundacetamideazacycleheteroaromatic compoundindole or derivativescarboxamide groupsecondary carboxylic acid amideorganic oxygen compoundpyrrolehydrocarbon derivativearyl phosphomonoesterbenzenoidorganic nitrogen compoundorganooxygen compound |
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