| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:27 UTC |
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| Update Date | 2025-03-25 00:47:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158992 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H13Cl2NO4 |
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| Molecular Mass | 317.0222 |
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| SMILES | OCC1OC(c2c[nH]c3cc(Cl)c(Cl)cc23)C(O)C1O |
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| InChI Key | LFYMLNMBBMTEEH-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 | aryl chloridesazacyclic compoundsbenzenoidsdialkyl ethersheteroaromatic compoundshydrocarbon derivativesmonosaccharidesorganochloridesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspyrrolessecondary alcoholstetrahydrofurans |
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| Substituents | etherindoleorganochloridemonosaccharideorganohalogen compounddialkyl ethersaccharidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholaryl chloridealcoholazacycletetrahydrofuranheteroaromatic compoundaryl halideoxacycleorganic oxygen compoundpyrrolesecondary alcoholhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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