Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:25:40 UTC |
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Update Date | 2025-03-21 18:39:04 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00123865 |
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Frequency | 20.8 |
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Structure | |
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Chemical Formula | C9H11ClN2O4 |
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Molecular Mass | 246.0407 |
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SMILES | O=c1ccn(C2CC(O)C(CCl)O2)c(=O)[nH]1 |
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InChI Key | UDJRRPRXUFONPJ-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 | 2',5'-dideoxyribonucleosides |
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Subclass | 2',5'-dideoxyribonucleosides |
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Direct Parent | 2',5'-dideoxyribonucleosides |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | alkyl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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Substituents | lactamaromatic heteromonocyclic compoundalkyl chlorideorganochloride2',5'-dideoxyribonucleosidemonosaccharidepyrimidoneorganohalogen compoundpyrimidinesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundalkyl halideorganoheterocyclic compoundalcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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