| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:17 UTC |
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| Update Date | 2025-03-21 18:36:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111049 |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C10H11ClN2O |
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| Molecular Mass | 210.056 |
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| SMILES | NCCc1c[nH]c2cc(Cl)c(O)cc12 |
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| InChI Key | XVOCIXHVGKWCNX-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-hydroxy-2-unsubstituted benzenoidsaryl chloridesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrroles |
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| Substituents | aryl chlorideazacycleindoleorganochlorideheteroaromatic compound1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundaryl halideorganic oxygen compoundaromatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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