| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:14:40 UTC |
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| Update Date | 2025-03-25 00:37:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02096874 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C46H82N3O13P2+ |
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| Molecular Mass | 946.5317 |
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| SMILES | CCCCCCC=CCCCCCCCC(=O)NC(COP(=O)(O)OP(=O)(O)OCC1OC([n+]2cccc(C(N)=O)c2)C(O)C1O)C(O)CCCCCCCC=CCCCCCCC |
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| InChI Key | VEIBPHPKFNHVEK-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 | pyridine nucleotides |
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| Subclass | pyridine nucleotides |
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| Direct Parent | pyridine nucleotides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonoalkyl phosphatesmonosaccharidesn-acyl aminesnicotinamidesorganic cationsorganic oxidesorganic pyrophosphatesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspentose phosphatesphosphoethanolaminesprimary carboxylic acid amidespyridinecarboxylic acids and derivativessecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
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| Substituents | primary carboxylic acid amidepyridine carboxylic acid or derivativesfatty acylcarbonyl grouparomatic heteromonocyclic compoundpentose phosphatenicotinamidefatty amidemonosaccharidepentose-5-phosphatecarboxylic acid derivativephosphoethanolaminesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganoheterocyclic compoundpyridine nucleotidealcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundhydroxypyridinemethylpyridinecarboxamide groupn-acyl-amineorganic pyrophosphateoxacyclesecondary carboxylic acid amidepyridineorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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