| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:52:16 UTC |
|---|
| Update Date | 2025-03-21 18:03:24 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00043979 |
|---|
| Frequency | 77.1 |
|---|
| Structure | |
|---|
| Chemical Formula | C14H25N4O2S+ |
|---|
| Molecular Mass | 313.1693 |
|---|
| SMILES | CNC(=C[N+](C)=O)NCCSCc1ccc(CN(C)C)o1 |
|---|
| InChI Key | LPGGHBQUCILMSO-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic nitrogen compounds |
|---|
| Class | organonitrogen compounds |
|---|
| Subclass | amines |
|---|
| Direct Parent | aralkylamines |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | aminoxidesdialkylaminesdialkylthioethersfuransheteroaromatic compoundshydrocarbon derivativesorganic cationsorganic oxidesorganic oxoazanium compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundssulfenyl compoundstrialkylamines |
|---|
| Substituents | furanaromatic heteromonocyclic compoundorganosulfur compoundaralkylamineorganic oxideorganopnictogen compoundorganic cationorganic oxoazaniumtertiary amineorganoheterocyclic compoundsecondary aliphatic aminesulfenyl compounddialkylthioetherheteroaromatic compoundtertiary aliphatic aminesecondary amineoxacycleorganic oxygen compoundaminoxidethioetherhydrocarbon derivativeorganooxygen compound |
|---|
