| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:14 UTC |
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| Update Date | 2025-03-21 18:02:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041460 |
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| Frequency | 82.8 |
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| Structure | |
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| Chemical Formula | C6H11O8P |
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| Molecular Mass | 242.0192 |
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| SMILES | O=C(O)CCC(CC(=O)O)OP(=O)(O)O |
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| InChI Key | IOOTZICDIGUKEI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | medium-chain hydroxy acids and derivatives |
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| Direct Parent | medium-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesmedium-chain fatty acidsmonoalkyl phosphatesorganic oxides |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidfatty acidcarboxylic acid derivativemedium-chain hydroxy acidorganic oxideorganic oxygen compoundphosphoric acid estermonoalkyl phosphatedicarboxylic acid or derivativeshydrocarbon derivativemedium-chain fatty acidorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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