Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:45:14 UTC |
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Update Date | 2025-03-25 00:48:20 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02167594 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C16H24O4 |
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Molecular Mass | 280.1675 |
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SMILES | CC(C)Cc1ccc(CC2OCC(O)C(O)C2O)cc1 |
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InChI Key | IFSLAXAHKFQSBI-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | benzenoids |
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Class | benzene and substituted derivatives |
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Subclass | phenylpropanes |
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Direct Parent | phenylpropanes |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | dialkyl ethershydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxanessecondary alcohols |
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Substituents | alcoholetheraromatic heteromonocyclic compoundmonosaccharidedialkyl etherphenylpropaneoxacyclesaccharideorganic oxygen compoundsecondary alcoholhydrocarbon derivativeoxaneorganoheterocyclic compoundorganooxygen compound |
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