Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:19:20 UTC |
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Update Date | 2025-03-21 18:36:04 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00108734 |
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Frequency | 24.6 |
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Structure | |
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Chemical Formula | C18H26O4 |
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Molecular Mass | 306.1831 |
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SMILES | Cc1c(C)c2c(c(C)c1O)C(C)(C)CC(C)(CCC(=O)O)O2 |
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InChI Key | GICZOMMQOOLPIQ-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 | benzopyrans |
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Subclass | 1-benzopyrans |
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Direct Parent | 1-benzopyrans |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | alkyl aryl ethersbenzenoidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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Substituents | carbonyl groupethercarboxylic acid1-benzopyranalkyl aryl ethercarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidorganooxygen compound |
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