Fusaperazine b
-
Formula: C18H24N2O4S
-
Molecular weight: 364.50
-
Smiles: CC(=CCOC1=CC=C(C=C1)CC2(C(=O)NC(C(=O)N2)SC)OC)C
Fusaperazine b
Names
-
Mycotoxin name: Fusaperazine b
-
First synonym: Fusaperazine b
-
Synonyms: Fusaperazine B,6beta-[4-[(3-Methyl-2-butenyl)oxy]benzyl]-6-methoxy-3beta-(methylthio)piperazine-2,5-dione
Identifiers / External links
-
CAS: 471241-47-1
-
PubChem CID: 10338814
-
ChemSpiderID: 8514273
-
Chemical Entities of Biological Interest (CHEBI): CHEBI:218321
Structure
-
Smiles: CC(=CCOC1=CC=C(C=C1)CC2(C(=O)NC(C(=O)N2)SC)OC)C
-
Isomeric smiles: CC(=CCOC1=CC=C(C=C1)C[C@@]2(C(=O)N[C@@H](C(=O)N2)SC)OC)C
-
Inchi: InChI=1S/C18H24N2O4S/c1-12(2)9-10-24-14-7-5-13(6-8-14)11-18(23-3)17(22)19-16(25-4)15(21)20-18/h5-9,16H,10-11H2,1-4H3,(H,19,22)(H,20,21)/t16-,18+/m1/s1
-
Inchikey: ZEWCHEYJHBQAHF-AEFFLSMTSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C18H24N2O4S
-
Molecular weight: 364.50
-
Monoisotopic mass: 364.14567842
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 527 Fusarium chlamydosporum OUPS-N124