| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 07:15:53 UTC |
|---|
| Update Date | 2025-03-24 19:58:55 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01095892 |
|---|
| Frequency | 1.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C45H82N3O22P3 |
|---|
| Molecular Mass | 1109.4603 |
|---|
| SMILES | CCCCCCCCCCCC(O)CC(=O)NC1C(OP(=O)(O)O)OC(COP(=O)(O)OP(=O)(O)OCC2OC(N3C=CCC(C(N)=O)=C3)C(O)C2O)C(O)C1OC(=O)CC(O)CCCCCCCCCCC |
|---|
| InChI Key | KYNHUZNFDMNRRZ-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | nucleosides, nucleotides, and analogues |
|---|
| Class | pyridine nucleotides |
|---|
| Subclass | nicotinamide nucleotides |
|---|
| Direct Parent | nicotinamide nucleotides |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | acylaminosugarsazacyclic compoundsbeta hydroxy acids and derivativescarbonyl compoundscarboxylic acid estersdihydropyridinesenaminesfatty acid estershexose phosphateshydrocarbon derivativesmonoalkyl phosphatesmonocarboxylic acids and derivativesmonosaccharidesn-acyl aminesn-acyl-alpha-hexosaminesn-substituted nicotinamidesorganic oxidesorganic pyrophosphatesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanespentose phosphatesprimary carboxylic acid amidessaccharolipidssecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
|---|
| Substituents | nicotinamidemonosaccharidepentose-5-phosphatenicotinamide-nucleotidebeta-hydroxy acidsaccharideorganonitrogen compounddihydropyridineoxaneorganoheterocyclic compoundalcoholvinylogous amideazacycleorganic pyrophosphatesecondary carboxylic acid amidefatty acid estermonoalkyl phosphatecarboxylic acid esterhydrocarbon derivativeenamineprimary carboxylic acid amidefatty acylcarbonyl grouppentose phosphatefatty amidecarboxylic acid derivativen-acyl-alpha-hexosamineorganic oxidealiphatic heteromonocyclic compoundorganopnictogen compoundamino saccharidetetrahydrofuranhydroxy acidcarboxamide groupn-acyl-aminen-substituted nicotinamideacylaminosugaroxacyclemonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid estersecondary alcoholhexose phosphateorganic nitrogen compoundsaccharolipidorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
|---|
