methylenolactocin
-
Formula: C11H16O4
-
Molecular weight: 212.24
-
Smiles: CCCCCC1C(C(=C)C(=O)O1)C(=O)O
methylenolactocin
Names
-
Mycotoxin name: methylenolactocin
-
First synonym: 112923-53-2
-
Synonyms: 112923-53-2,3-Carboxy-2-methylene-4-nonanolide,(-)-Methylenolactocin,DTXSID40920955,(2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid,4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid,3-Furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-pentyl-, trans-(-)-
Identifiers / External links
-
CAS: 112923-53-2
-
PubChem CID: 133968
-
ChemSpiderID: 118131
-
Wikidata (wiki): Q15425832
-
Chemical Entities of Biological Interest (CHEBI): CHEBI:211686
-
CompTox Chemicals Dashboard (DTXSID): DTXSID40920955
Structure
-
Smiles: CCCCCC1C(C(=C)C(=O)O1)C(=O)O
-
Isomeric smiles: CCCCCC1C(C(=C)C(=O)O1)C(=O)O
-
Inchi: InChI=1S/C11H16O4/c1-3-4-5-6-8-9(10(12)13)7(2)11(14)15-8/h8-9H,2-6H2,1H3,(H,12,13)
-
Inchikey: YZCRACGZKLIGLZ-UHFFFAOYSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C11H16O4
-
Molecular weight: 212.24
-
Monoisotopic mass: 212.10485899
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 974 Penicillium sp. strain No. 24-4