Record Information |
---|
HMDB Status | Not Available |
---|
Creation Date | 2024-02-21 00:15:42 UTC |
---|
Update Date | 2025-03-21 18:34:12 UTC |
---|
HMDB ID | Not Available |
---|
Metabolite Identification |
---|
DeepMet ID | DMID00099730 |
---|
Frequency | 27.5 |
---|
Structure | |
---|
Chemical Formula | C17H23NO3 |
---|
Molecular Mass | 289.1678 |
---|
SMILES | COc1ccc2c(OCC(O)CNC(C)C)cccc2c1 |
---|
InChI Key | NYMXVBIZRYJLOY-UHFFFAOYSA-N |
---|
Chemical Taxonomy |
---|
Kingdom | organic compounds |
---|
Superclass | benzenoids |
---|
Class | naphthalenes |
---|
Subclass | naphthalenes |
---|
Direct Parent | naphthalenes |
---|
Geometric Descriptor | aromatic homopolycyclic compounds |
---|
Alternative Parents | alkyl aryl ethersanisolesdialkylamineshydrocarbon derivativesorganopnictogen compoundssecondary alcohols |
---|
Substituents | alcoholphenol ethersecondary aliphatic amineetheraromatic homopolycyclic compoundalkyl aryl ethersecondary aminenaphthaleneorganic oxygen compoundanisoleorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
---|