| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:11:59 UTC |
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| Update Date | 2025-03-25 00:58:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02228766 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H27NO12 |
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| Molecular Mass | 425.1533 |
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| SMILES | CC(=O)NC1C(O)C(OC2OC(C)C(O)C(O)C2O)C(=O)OC1C(O)C(O)CO |
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| InChI Key | MIRYRPZYKWHCSR-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 | gluconolactones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | acetalsacetamidescarbonyl compoundscarboxylic acid estersdelta valerolactoneshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholssecondary alcoholssecondary carboxylic acid amides |
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| Substituents | carbonyl groupdelta valerolactonecarboxylic acid derivativelactoneorganic oxideacetalgluconolactonealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholdelta_valerolactoneorganoheterocyclic compoundacetamidealcoholcarboxamide groupoxacyclesecondary carboxylic acid amidemonocarboxylic acid or derivativescarboxylic acid estersecondary alcoholhydrocarbon derivativeorganic nitrogen compound |
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