| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:47:41 UTC |
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| Update Date | 2025-03-25 00:49:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02173148 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H21N3O |
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| Molecular Mass | 199.1685 |
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| SMILES | CCC(C)C(N)C(=O)N1CCCNC1 |
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| InChI Key | OVKHMBLQMQLHNS-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | isoleucine and derivatives |
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| Geometric Descriptor | aliphatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acid amidesalpha amino acidsazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylaminesdiazinaneshydrocarbon derivativesmonoalkylaminesorganic oxidesorganopnictogen compoundstertiary carboxylic acid amides |
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| Substituents | carbonyl group1,3-diazinaneorganic oxidetertiary carboxylic acid amidealiphatic heteromonocyclic compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundisoleucine or derivativesorganoheterocyclic compoundsecondary aliphatic aminealpha-amino acid amideazacyclesecondary aminecarboxamide grouporganic oxygen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compoundamine |
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