| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:14 UTC |
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| Update Date | 2025-03-25 01:01:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02247654 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H26O8 |
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| Molecular Mass | 394.1628 |
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| SMILES | Cc1c(C)c2c(c(C)c1O)CCC(C)(CCC(=O)OC(CC(=O)O)C(=O)O)O2 |
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| InChI Key | GJGOXRROJIUSDN-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 acid esterscarboxylic acidsfatty acid estershydrocarbon derivativesorganic oxidesoxacyclic compoundstricarboxylic acids and derivatives |
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| Substituents | fatty acylcarbonyl groupethercarboxylic acid1-benzopyrantricarboxylic acid or derivativesalkyl aryl ethercarboxylic acid derivativeoxacyclefatty acid esterorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundcarboxylic acid esterhydrocarbon derivativebenzenoidorganooxygen compound |
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