2,3-dihydro-4-(4-methoxyphenyl)-1h-phenalene-1,2,3-triol
-
Formula: C20H18O4
-
Molecular weight: 322.40
-
Smiles: COC1=CC=C(C=C1)C2=C3C(C(C(C4=CC=CC(=C43)C=C2)O)O)O
2,3-dihydro-4-(4-methoxyphenyl)-1h-phenalene-1,2,3-triol
Names
-
Mycotoxin name: 2,3-dihydro-4-(4-methoxyphenyl)-1h-phenalene-1,2,3-triol
-
First synonym: 2,3-dihydro-4-(4-methoxyphenyl)-1h-phenalene-1,2,3-triol
-
Synonyms: 2,3-Dihydro-4-(4-methoxyphenyl)-1H-phenalene-1,2,3-triol,CHEBI:175115,1,2-dihydro-1,2,3-trihydroxy-9-(4-methoxyphenyl)phenalene,4-(4-methoxyphenyl)-2,3-dihydro-1H-phenalene-1,2,3-triol
Identifiers / External links
-
CAS: 163811-78-7
-
PubChem CID: 74027046
-
ChemSpiderID: 35015172
-
Chemical Entities of Biological Interest (CHEBI): CHEBI:175115
-
CompTox Chemicals Dashboard (DTXSID): DTXSID901199316
Structure
-
Smiles: COC1=CC=C(C=C1)C2=C3C(C(C(C4=CC=CC(=C43)C=C2)O)O)O
-
Isomeric smiles: COC1=CC=C(C=C1)C2=C3C(C(C(C4=CC=CC(=C43)C=C2)O)O)O
-
Inchi: InChI=1S/C20H18O4/c1-24-13-8-5-11(6-9-13)14-10-7-12-3-2-4-15-16(12)17(14)19(22)20(23)18(15)21/h2-10,18-23H,1H3
-
Inchikey: UBACNSNNFBHJLG-UHFFFAOYSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C20H18O4
-
Molecular weight: 322.40
-
Monoisotopic mass: 322.12050905
Select an endpoint:
| Endpoint | Tool | QSAR ID | Value | Unit | Comments | Reference |
|---|
Select an endpoint:
| Category | Endpoint | Tool | QSAR ID | Value | Unit | Comments | Reference |
|---|
Select an endpoint:
| Category | Sub category | Endpoint | Tool | QSAR ID | Value | Unit | Comments | Reference |
|---|
Select an endpoint:
| Endpoint | Tool | Value | Unit | Comments | Reference |
|---|
Fungi
-
Fungi id Species 546 Fusarium oxysporum