| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:53:21 UTC |
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| Update Date | 2025-03-25 01:13:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02323542 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C44H79N3O18P2 |
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| Molecular Mass | 999.4834 |
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| SMILES | CCCCCCCCCCCC(O)CC(=O)NC1OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=CCC(C(N)=O)=C3)C(O)C2O)C(O)C1OC(=O)CC(O)CCCCCCCCCCC |
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| InChI Key | RPIRQMARXJGLCV-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 | pyridine nucleotides |
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| Subclass | nicotinamide nucleotides |
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| Direct Parent | nicotinamide nucleotides |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acid estersdihydropyridinesenaminesfatty acid estershydrocarbon derivativesmonoalkyl phosphatesmonocarboxylic acids and derivativesmonosaccharidesn-acyl aminesn-substituted nicotinamidesorganic oxidesorganic pyrophosphatesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary carboxylic acid amidessecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
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| Substituents | primary carboxylic acid amidefatty acylcarbonyl grouppentose phosphatenicotinamidefatty amidemonosaccharidepentose-5-phosphatenicotinamide-nucleotidecarboxylic acid derivativebeta-hydroxy acidsaccharideorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compounddihydropyridineorganoheterocyclic compoundalcoholvinylogous amideazacycletetrahydrofuranhydroxy acidcarboxamide groupn-acyl-amineorganic pyrophosphaten-substituted nicotinamideoxacyclesecondary carboxylic acid amidefatty acid estermonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid estermonoalkyl phosphatecarboxylic acid estersecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compoundenamine |
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