| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:20 UTC |
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| Update Date | 2025-03-21 18:03:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00046577 |
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| Frequency | 71.9 |
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| Structure | |
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| Chemical Formula | C12H13NO6 |
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| Molecular Mass | 267.0743 |
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| SMILES | Oc1cc2cc[nH]c2cc1OC1OC(O)C(O)C1O |
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| InChI Key | VJCSYUZRTBZLFG-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 | 1,2-diols1-hydroxy-2-unsubstituted benzenoidsacetalsazacyclic compoundshemiacetalsheteroaromatic compoundshydrocarbon derivativesmonosaccharidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsphenol etherspyrrolessecondary alcoholstetrahydrofurans |
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| Substituents | phenol etherindole1-hydroxy-2-unsubstituted benzenoidmonosaccharidesaccharideacetalaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhemiacetal1,2-diolalcoholazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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