| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:38 UTC |
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| Update Date | 2025-03-21 18:32:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00092308 |
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| Frequency | 30.3 |
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| Structure | |
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| Chemical Formula | C12H16N2O |
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| Molecular Mass | 204.1263 |
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| SMILES | NCCCC(O)c1c[nH]c2ccccc12 |
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| InChI Key | FCIRMZXVIKBKKZ-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 | aromatic alcoholsazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganopnictogen compoundspyrrolessecondary alcohols |
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| Substituents | aromatic alcoholalcoholazacycleindoleheteroaromatic compoundorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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