Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:36:12 UTC |
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Update Date | 2025-03-21 17:57:14 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00006595 |
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Frequency | 780.7 |
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Structure | |
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Chemical Formula | C16H22O7 |
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Molecular Mass | 326.1366 |
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SMILES | CC=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)c(OC)c1 |
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InChI Key | KEOQVSSHVYLFJO-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 | phenol ethers |
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Subclass | anisoles |
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Direct Parent | anisoles |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | acetalsalkyl aryl ethershydrocarbon derivativesmethoxybenzenesmonosaccharidesoxacyclic compoundsoxanesphenoxy compoundsprimary alcoholssecondary alcohols |
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Substituents | alcoholmonocyclic benzene moietyetheraromatic heteromonocyclic compoundmonosaccharidealkyl aryl ethermethoxybenzeneoxacyclesaccharideorganic oxygen compoundacetalanisolesecondary alcoholhydrocarbon derivativephenoxy compoundoxaneprimary alcoholorganoheterocyclic compoundorganooxygen compound |
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