| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:59:35 UTC |
|---|
| Update Date | 2025-03-25 00:53:32 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02200311 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C18H16ClN5 |
|---|
| Molecular Mass | 337.1094 |
|---|
| SMILES | N=C(NC(=N)Nc1cccc2ccccc12)Nc1ccc(Cl)cc1 |
|---|
| InChI Key | VILPPTBVCLEPME-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | naphthalenes |
|---|
| Subclass | naphthalenes |
|---|
| Direct Parent | naphthalenes |
|---|
| Geometric Descriptor | aromatic homopolycyclic compounds |
|---|
| Alternative Parents | aryl chloridesbiguanidescarboximidamideschlorobenzeneshydrocarbon derivativesiminesorganochloridesorganopnictogen compounds |
|---|
| Substituents | aryl chloridechlorobenzenemonocyclic benzene moietyguanidineimineorganochloridearomatic homopolycyclic compoundcarboximidamideorganohalogen compoundaryl halidenaphthaleneorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundbiguanidehalobenzene |
|---|
