| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:38 UTC |
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| Update Date | 2025-03-25 00:54:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02205007 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H22ClO13P |
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| Molecular Mass | 440.0487 |
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| SMILES | O=P(O)(O)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CCl)C(O)C1O |
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| InChI Key | QXIVNXNBUUEHOO-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | pentose phosphates |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alkyl chlorideshydrocarbon derivativesketalsmonoalkyl phosphatesmonosaccharidesorganic oxidesorganochloridesoxacyclic compoundsoxanesprimary alcoholssecondary alcoholstetrahydrofurans |
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| Substituents | pentose phosphatealkyl chlorideorganochloridepentose-5-phosphateorganohalogen compoundorganic oxideacetalketalaliphatic heteromonocyclic compoundalkyl halideoxaneprimary alcoholorganoheterocyclic compoundalcoholtetrahydrofuranoxacyclephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeorganic phosphoric acid derivativealkyl phosphate |
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