DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 14:45:44 UTC
Update Date	2025-03-25 00:48:31 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02168708
Frequency	0.5
Structure
Chemical Formula	C₁₃H₂₁N₄O₉P
Molecular Mass	408.1046
SMILES	CC(C)C(=O)NC(=O)c1ncn(C2OC(COP(=O)(O)O)C(O)C2O)c1N
InChI Key	OGPWKKMQPSGLBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	imidazole ribonucleosides and ribonucleotides
Subclass	1-ribosyl-imidazolecarboxamides
Direct Parent	1-ribosyl-imidazolecarboxamides
Geometric Descriptor	aromatic heteromonocyclic compounds
Alternative Parents	1,2-diols amino acids and derivatives azacyclic compounds carbonyl compounds carbonylimidazoles carboxylic acids and derivatives dicarboximides heteroaromatic compounds hydrocarbon derivatives imidazoles monoalkyl phosphates monosaccharides n-substituted imidazoles n-unsubstituted carboxylic acid imides organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary amines secondary alcohols tetrahydrofurans vinylogous amides
Substituents	carbonyl group aromatic heteromonocyclic compound pentose phosphate amino acid or derivatives monosaccharide pentose-5-phosphate carboxylic acid derivative carboxylic acid imide, n-unsubstituted saccharide organic oxide imidazole organonitrogen compound organopnictogen compound imidazole-4-carbonyl group dicarboximide organoheterocyclic compound azole 1,2-diol n-substituted imidazole alcohol vinylogous amide azacycle tetrahydrofuran heteroaromatic compound 1-ribosyl-imidazolecarboxamide carboxylic acid imide oxacycle organic oxygen compound phosphoric acid ester monoalkyl phosphate secondary alcohol hydrocarbon derivative primary amine organic nitrogen compound organic phosphoric acid derivative amine alkyl phosphate organooxygen compound

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