Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:52:52 UTC |
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Update Date | 2025-03-25 00:51:09 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02185016 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C13H15NO5 |
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Molecular Mass | 265.095 |
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SMILES | OCC1OC(n2ccc3cc(O)c(O)cc32)CC1O |
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InChI Key | ZRCWNDOMGSEJTN-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 | n-alkylindoles |
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Direct Parent | n-alkylindoles |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesmonosaccharidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholssubstituted pyrrolestetrahydrofurans |
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Substituents | n-alkylindoleindole1-hydroxy-2-unsubstituted benzenoidmonosaccharidesubstituted pyrrolesaccharidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholalcoholazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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