| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:59:21 UTC |
|---|
| Update Date | 2025-03-25 00:53:27 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02199770 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C15H13ClO |
|---|
| Molecular Mass | 244.0655 |
|---|
| SMILES | Clc1ccc(C2CCOc3ccccc32)cc1 |
|---|
| InChI Key | XXHAZJWYLWWDQM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | phenylpropanoids and polyketides |
|---|
| Class | neoflavonoids |
|---|
| Subclass | neoflavans |
|---|
| Direct Parent | neoflavans |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-benzopyransalkyl aryl ethersaryl chlorideschlorobenzeneshydrocarbon derivativesorganochloridesoxacyclic compounds |
|---|
| Substituents | neoflavanaryl chloridechlorobenzenemonocyclic benzene moietyetherbenzopyran1-benzopyranorganochloridealkyl aryl etherorganohalogen compoundaryl halideoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundchromanehydrocarbon derivativebenzenoidhalobenzeneorganoheterocyclic compoundorganooxygen compound |
|---|
