| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:52:15 UTC |
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| Update Date | 2025-03-25 00:50:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02183611 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H12O9 |
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| Molecular Mass | 252.0481 |
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| SMILES | O=C1OC(C(O)C(=O)O)C(O)C(O)C(O)C1O |
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| InChI Key | HANSBFFGILESPL-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | lactones |
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| Subclass | lactones |
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| Direct Parent | lactones |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha hydroxy acids and derivativescarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesoxacyclic compoundsoxepanessecondary alcohols |
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| Substituents | alcoholcaprolactonecarbonyl groupcarboxylic acidalpha-hydroxy acidhydroxy acidcarboxylic acid derivativelactoneoxepaneoxacycleorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic heteromonocyclic compoundsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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