| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:46 UTC |
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| Update Date | 2025-03-25 00:59:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235097 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H24N2O5 |
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| Molecular Mass | 372.1685 |
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| SMILES | Cc1cc2c3cccnc3n(CC(O)C(O)CC(O)CC(=O)O)c2cc1C |
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| InChI Key | DIYWVKODWDJAHW-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 | pyridoindoles |
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| Direct Parent | alpha carbolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesamino fatty acidsazacyclic compoundsbenzenoidsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acidsheteroaromatic compoundsheterocyclic fatty acidshydrocarbon derivativeshydroxy fatty acidshydroxypyridinesindolesmedium-chain fatty acidsmedium-chain hydroxy acids and derivativesmethylpyridinesmonocarboxylic acids and derivativesn-alkylindolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyrrolopyridinessecondary alcoholssubstituted pyrroles |
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| Substituents | fatty acylcarbonyl groupn-alkylindolecarboxylic acidheterocyclic fatty acidindolepolyhalopyridinefatty acidsubstituted pyrrolecarboxylic acid derivativemedium-chain hydroxy acidbeta-hydroxy acidorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundmedium-chain fatty acidhydroxy fatty acid2-halopyridinealcoholazacyclepyrrolopyridineheteroaromatic compoundhydroxypyridinemethylpyridinehydroxy acidamino fatty acidmonocarboxylic acid or derivativespyridineorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativealpha-carbolinebenzenoidorganic nitrogen compoundorganooxygen compound |
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