| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:33 UTC |
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| Update Date | 2025-03-25 00:53:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02200252 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H20N6O2 |
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| Molecular Mass | 268.1648 |
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| SMILES | N=C(N)NCCCC(NCCc1c[nH]cn1)C(=O)O |
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| InChI Key | CYQCDQRJKXIRKS-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 | arginine and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboximidamidescarboxylic acidsdialkylaminesguanidinesheteroaromatic compoundshydrocarbon derivativesimidazolesiminesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compounds |
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| Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundamino acidguanidineimineorganic oxideimidazolearginine or derivativesorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundazolesecondary aliphatic amineazacycleheteroaromatic compoundcarboximidamidesecondary aminemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
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