| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:07 UTC |
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| Update Date | 2025-03-25 00:49:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02176481 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H13O4PS |
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| Molecular Mass | 236.0272 |
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| SMILES | CCc1scc(C)c1COP(=O)(O)O |
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| InChI Key | UGWRBJKFSYQIAT-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 | organic phosphoric acids and derivatives |
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| Subclass | phosphate esters |
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| Direct Parent | monoalkyl phosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | heteroaromatic compoundshydrocarbon derivativesorganic oxidesorganooxygen compoundsthiophenes |
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| Substituents | aromatic heteromonocyclic compoundheteroaromatic compoundthiopheneorganic oxideorganic oxygen compoundmonoalkyl phosphatehydrocarbon derivativeorganoheterocyclic compoundorganooxygen compound |
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