DeepMet

Record Information
HMDB Status	Not Available
Creation Date	2024-02-21 15:02:50 UTC
Update Date	2025-03-25 00:54:39 UTC
HMDB ID	Not Available
Metabolite Identification
DeepMet ID	DMID02207722
Frequency	0.5
Structure
Chemical Formula	C₁₅H₂₁N₇O₅
Molecular Mass	379.1604
SMILES	Nc1ncnc2c1ncn2C1CC(O)C(CNC(=O)CCC(N)C(=O)O)O1
InChI Key	CGYUUCJDYMOANS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdom	organic compounds
Superclass	nucleosides, nucleotides, and analogues
Class	2',5'-dideoxyribonucleosides
Subclass	2',5'-dideoxyribonucleosides
Direct Parent	2',5'-dideoxyribonucleosides
Geometric Descriptor	aromatic heteropolycyclic compounds
Alternative Parents	alpha amino acids amino acids azacyclic compounds carbonyl compounds carboxylic acids glutamine and derivatives heteroaromatic compounds hydrocarbon derivatives imidazoles imidolactams monoalkylamines monocarboxylic acids and derivatives monosaccharides n-acyl amines n-substituted imidazoles organic oxides organopnictogen compounds oxacyclic compounds purines and purine derivatives pyrimidines and pyrimidine derivatives secondary alcohols secondary carboxylic acid amides tetrahydrofurans
Substituents	fatty acyl carbonyl group carboxylic acid glutamine or derivatives amino acid or derivatives amino acid 2',5'-dideoxyribonucleoside fatty amide monosaccharide alpha-amino acid or derivatives imidazopyrimidine carboxylic acid derivative pyrimidine saccharide organic oxide aromatic heteropolycyclic compound imidazole organonitrogen compound alpha-amino acid organopnictogen compound imidolactam organoheterocyclic compound azole n-substituted imidazole alcohol azacycle tetrahydrofuran heteroaromatic compound carboxamide group n-acyl-amine oxacycle secondary carboxylic acid amide monocarboxylic acid or derivatives organic oxygen compound secondary alcohol hydrocarbon derivative primary aliphatic amine primary amine purine organic nitrogen compound amine organooxygen compound

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