| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:42:49 UTC |
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| Update Date | 2025-03-25 01:32:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02438803 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C27H39N8O22P3 |
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| Molecular Mass | 920.1392 |
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| SMILES | CC(=O)NC1C(OP(=O)(OCC2OC(n3cnc4c(N)ncnc43)C(O)C2O)OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)[nH]c3=O)CC2O)OC(CO)C(O)C1O |
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| InChI Key | HNPJFHHBYZZJEG-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 | monosaccharides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | acetamidesamino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkyl phosphatesheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamslactamsmonoalkyl phosphatesn-acyl-alpha-hexosaminesn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanespentose phosphatesprimary alcoholsprimary aminespurine ribonucleoside monophosphatespurine ribonucleoside triphosphatespurines and purine derivativespyrimidine 2'-deoxyribonucleoside triphosphatespyrimidonessecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
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| Substituents | lactamamino acid or derivativespurine ribonucleoside monophosphatemonosaccharidepentose-5-phosphateimidazopyrimidinepyrimidine 2'-deoxyribonucleoside triphosphateorganonitrogen compoundoxanepurine ribonucleoside triphosphateorganoheterocyclic compoundacetamidealcoholvinylogous amideazacycleheteroaromatic compoundsecondary carboxylic acid amidemonoalkyl phosphatehydrocarbon derivativeprimary amineaminecarbonyl grouppentose phosphatepyrimidonecarboxylic acid derivativepyrimidinen-acyl-alpha-hexosamineorganic oxidearomatic heteropolycyclic compoundimidazoleorganopnictogen compoundprimary alcoholimidolactamazolen-substituted imidazolecarbonic acid derivativetetrahydrofurancarboxamide groupoxacycledialkyl phosphatephosphoric acid estersecondary alcoholpurineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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