| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:37:05 UTC |
|---|
| Update Date | 2025-03-21 17:57:33 UTC |
|---|
| HMDB ID | HMDB0015646 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00008671 |
|---|
| Name | Desvenlafaxine |
|---|
| Frequency | 563.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C16H25NO2 |
|---|
| Molecular Mass | 263.1885 |
|---|
| SMILES | CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 |
|---|
| InChI Key | KYYIDSXMWOZKMP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | cyclohexanols |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1,3-aminoalcohols1-hydroxy-2-unsubstituted benzenoidsbenzene and substituted derivativescyclic alcohols and derivativeshydrocarbon derivativesorganopnictogen compoundstertiary alcoholstrialkylamines |
|---|
| Substituents | monocyclic benzene moiety1,3-aminoalcoholtertiary aliphatic aminecyclohexanol1-hydroxy-2-unsubstituted benzenoidcyclic alcoholaromatic homomonocyclic compoundtertiary alcoholorganonitrogen compoundorganopnictogen compoundphenolhydrocarbon derivativebenzenoidorganic nitrogen compoundaminetertiary amine |
|---|
