| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:36 UTC |
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| Update Date | 2025-03-25 00:57:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02223545 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H21N3O3 |
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| Molecular Mass | 267.1583 |
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| SMILES | NC(=O)CC(N)CCCCn1c(C=O)ccc1CO |
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| InChI Key | YARVTOTXWUIPEP-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 | beta amino acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aromatic alcoholsaryl-aldehydesazacyclic compoundscarboxylic acids and derivativesfatty amidesheteroaromatic compoundshydrocarbon derivativesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsprimary carboxylic acid amidessubstituted pyrroles |
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| Substituents | aromatic alcoholprimary carboxylic acid amidefatty acylcarbonyl grouparomatic heteromonocyclic compoundfatty amidesubstituted pyrroleorganic oxidearyl-aldehydeorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundalcoholazacycleheteroaromatic compoundaldehydecarboxamide groupbeta amino acid or derivativesorganic oxygen compoundpyrrolehydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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