DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:20:26 UTC
Update Date	2025-03-25 01:01:16 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02248114
Frequency	0.5
Structure
Chemical Formula	C₉H₁₆N₃O₈P
Molecular Mass	325.0675
SMILES	NC(=O)C1=CN(C2OC(COP(=O)(O)O)C(O)C2O)CN1
InChI Key	PDGUFUZPQUVEDZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	imidazole ribonucleosides and ribonucleotides
Subclass	1-ribosyl-imidazolecarboxamides
Direct Parent	1-phosphoribosyl-imidazolecarboxamides
Geometric Descriptor	aliphatic heteromonocyclic compounds
Alternative Parents	1,2-diols 1-phosphoribosyl-imidazoles alpha amino acids azacyclic compounds carbonyl compounds carboxylic acids and derivatives dialkylamines enamines hydrocarbon derivatives imidazoles imidazolines monoalkyl phosphates monosaccharides organic oxides organopnictogen compounds oxacyclic compounds pentose phosphates primary carboxylic acid amides secondary alcohols tetrahydrofurans vinylogous amides
Substituents	primary carboxylic acid amide carbonyl group pentose phosphate amino acid or derivatives monosaccharide pentose-5-phosphate alpha-amino acid or derivatives carboxylic acid derivative saccharide organic oxide imidazole 1-phosphoribosyl-imidazole aliphatic heteromonocyclic compound organonitrogen compound alpha-amino acid organopnictogen compound organoheterocyclic compound 1,2-diol alcohol vinylogous amide secondary aliphatic amine azacycle tetrahydrofuran 1-phosphoribosyl-imidazolecarboxamide secondary amine carboxamide group oxacycle organic oxygen compound phosphoric acid ester imidazoline monoalkyl phosphate secondary alcohol 4-imidazoline hydrocarbon derivative organic nitrogen compound organic phosphoric acid derivative alkyl phosphate organooxygen compound amine enamine

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