| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:13 UTC |
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| Update Date | 2025-03-25 00:51:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02188136 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H34N4O17P2 |
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| Molecular Mass | 688.1394 |
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| SMILES | CC(=O)NC1CC=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cc(C)c(=O)[nH]c4=O)C(O)C3O)C(O)C2O)C1O |
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| InChI Key | SYFFHNZCBAQREI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | nucleosides, nucleotides, and analogues |
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| Class | pyrimidine nucleotides |
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| Subclass | pyrimidine ribonucleotides |
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| Direct Parent | pyrimidine ribonucleoside diphosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | acetamidesalkanolaminesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeslactamsmonoalkyl phosphatesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganic pyrophosphatesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspentose phosphatespyrimidonessecondary alcoholssecondary carboxylic acid amidestetrahydrofuranstetrahydropyridinesvinylogous amides |
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| Substituents | carbonyl grouplactamaromatic heteromonocyclic compoundpentose phosphatemonosaccharidepentose-5-phosphatepyrimidonecarboxylic acid derivativepyrimidinesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundacetamidealkanolaminealcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundtetrahydropyridinecarboxamide grouporganic pyrophosphateoxacyclesecondary carboxylic acid amidepyrimidine ribonucleoside diphosphateorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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