| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 02:38:29 UTC |
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| Update Date | 2025-03-21 21:54:13 UTC |
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| HMDB ID | HMDB0255203 |
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| Metabolite Identification |
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| DeepMet ID | DMID00434661 |
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| Name | N-Nitrosodiethanolamine |
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| Frequency | 4.1 |
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| Structure | |
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| Chemical Formula | C4H10N2O3 |
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| Molecular Mass | 134.0691 |
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| SMILES | O=NN(CCO)CCO |
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| InChI Key | YFCDLVPYFMHRQZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | organic nitroso compounds |
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| Direct Parent | organic n-nitroso compounds |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alcohols and polyolsalkanolamineshydrocarbon derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | alcoholaliphatic acyclic compoundorganic n-nitroso compoundorganic oxideorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeorganooxygen compoundalkanolamine |
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