| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:10 UTC |
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| Update Date | 2025-03-25 00:46:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02158353 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H13Cl2NO4 |
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| Molecular Mass | 293.0222 |
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| SMILES | OCC1OC(Nc2cc(Cl)ccc2Cl)C(O)C1O |
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| InChI Key | VIUFAYVYUUHONP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | dichlorobenzenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl chlorideshydrocarbon derivativesmonosaccharidesorganochloridesorganopnictogen compoundsoxacyclic compoundsphenylalkylaminesprimary alcoholssecondary alcoholssecondary alkylarylaminestetrahydrofurans |
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| Substituents | aromatic heteromonocyclic compoundorganochloridemonosaccharideorganohalogen compoundsaccharideorganonitrogen compoundorganopnictogen compoundprimary alcoholorganoheterocyclic compoundaryl chloridealcohol1,4-dichlorobenzenetetrahydrofuransecondary aminesecondary aliphatic/aromatic aminearyl halideoxacycleorganic oxygen compoundsecondary alcoholphenylalkylaminehydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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