| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:56 UTC |
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| Update Date | 2025-03-25 01:01:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251540 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H16N2O3 |
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| Molecular Mass | 272.1161 |
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| SMILES | OCC1OC(n2ccc3c4ccccc4[nH]c32)CC1O |
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| InChI Key | FJIHZXBJYSQRHS-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 | pyrroloindoles |
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| Direct Parent | pyrroloindoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsazolesbenzenoidsheteroaromatic compoundshydrocarbon derivativesindolesmonosaccharidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholssecondary alcoholssubstituted pyrrolestetrahydrofurans |
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| Substituents | indolemonosaccharidesubstituted pyrrolepyrroloindolesaccharidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholazolealcoholazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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