| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:25 UTC |
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| Update Date | 2025-03-25 00:45:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02149784 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H30O4 |
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| Molecular Mass | 334.2144 |
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| SMILES | Cc1c(C)c2c(c(C)c1O)CCC(C)(CCC(C(=O)O)C(C)C)O2 |
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| InChI Key | JOQCOKMQUOIVES-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | prenol lipids |
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| Subclass | sesquiterpenoids |
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| Direct Parent | sesquiterpenoids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-benzopyransalkyl aryl ethersbenzenoidscarbonyl compoundscarboxylic acidsheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesoxacyclic compounds |
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| Substituents | fatty acylcarbonyl groupethercarboxylic acid1-benzopyranheterocyclic fatty acidfatty acidalkyl aryl ethercarboxylic acid derivativemedium-chain hydroxy acidorganic oxidesesquiterpenoidaromatic heteropolycyclic compoundchromanemedium-chain fatty acidhydroxy fatty acidorganoheterocyclic compoundbenzopyranmethyl-branched fatty acidbranched fatty acidoxacyclemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativebenzenoidorganooxygen compound |
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