Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:50:04 UTC |
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Update Date | 2025-03-21 18:02:33 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00038713 |
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Frequency | 90.3 |
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Structure | |
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Chemical Formula | C20H27NO12 |
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Molecular Mass | 473.1533 |
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SMILES | OCC1OC(OCC2OC(Oc3cc4[nH]ccc4cc3O)C(O)C(O)C2O)C(O)C(O)C1O |
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InChI Key | BERTYQHLPCNZBY-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 | indoles and derivatives |
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Subclass | indoles |
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Direct Parent | indoles |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsacetalsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmonosaccharidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanesphenol ethersprimary alcoholspyrrolessecondary alcohols |
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Substituents | phenol etherindole1-hydroxy-2-unsubstituted benzenoidmonosaccharidesaccharideacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholalcoholazacycleheteroaromatic compoundoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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