| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-21 00:19:09 UTC |
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| Update Date | 2025-03-21 18:35:59 UTC |
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| HMDB ID | HMDB0001413 |
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| Metabolite Identification |
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| DeepMet ID | DMID00108280 |
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| Name | Citicoline |
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| Frequency | 24.8 |
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| Structure | |
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| Chemical Formula | C14H27N4O11P2+ |
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| Molecular Mass | 489.1146 |
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| SMILES | C[N+](C)(C)CCOP(=O)(O)OP(=O)(O)OCC1OC(n2ccc(N)nc2=O)C(O)C1O |
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| InChI Key | RZZPDXZPRHQOCG-UHFFFAOYSA-O |
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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 | 1,2-diolsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesmonosaccharidesorganic carbonic acids and derivativesorganic cationsorganic oxidesorganic pyrophosphatesorganic saltsorganopnictogen compoundsoxacyclic compoundspentose phosphatesphosphocholinesprimary aminespyrimidonessecondary alcoholstetraalkylammonium saltstetrahydrofurans |
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| Substituents | aromatic heteromonocyclic compoundpentose phosphatemonosaccharidepentose-5-phosphatepyrimidonepyrimidinesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltimidolactamorganoheterocyclic compound1,2-diolalcoholcarbonic acid derivativetetraalkylammonium saltazacycletetrahydrofuranquaternary ammonium saltheteroaromatic compoundorganic pyrophosphatephosphocholineoxacyclepyrimidine ribonucleoside diphosphateorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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