6-hydroxyisoquadrone
-
Formula: C15H20O4
-
Molecular weight: 264.32
-
Smiles: CC1(CC23C4CCC1C2CC(=O)C3(OC4=O)CO)C
6-hydroxyisoquadrone
Names
-
Mycotoxin name: 6-hydroxyisoquadrone
-
First synonym: 93078-74-1
-
Synonyms: 93078-74-1,6-Hydroxyisoquadrone,2H-5,7b-Ethanoindeno(1,7-bc)furan-2,7(7ah)-dione, hexahydro-9,9-dimethyl-7a-(hydroxymethyl)(2a-alpha,5-alpha,5a-beta,7a-alpha,7b-alpha)-(+)-,DTXSID10918728,7a-(Hydroxymethyl)-9,9-dimethylhexahydro-2H-5,7b-ethanoindeno[1,7-bc]furan-2,7(7aH)-dione
Identifiers / External links
-
CAS: 93078-74-1
-
PubChem CID: 24837954
-
CompTox Chemicals Dashboard (DTXSID): DTXSID10918728
Structure
-
Smiles: CC1(CC23C4CCC1C2CC(=O)C3(OC4=O)CO)C
-
Isomeric smiles: CC1(CC23C4CCC1C2CC(=O)C3(OC4=O)CO)C
-
Inchi: InChI=1S/C15H20O4/c1-13(2)6-14-9-4-3-8(13)10(14)5-11(17)15(14,7-16)19-12(9)18/h8-10,16H,3-7H2,1-2H3
-
Inchikey: WUCRGJAHBCTMHG-UHFFFAOYSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C15H20O4
-
Molecular weight: 264.32
-
Monoisotopic mass: 264.13615911
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 263 Aspergillus terreus