Kasanosin c
-
Formula: C22H24O7
-
Molecular weight: 400.40
-
Smiles: CC=CC1=CC2=C(CO1)C(=O)C(C(C2)O)(C)OC(=O)C3=C(C=C(C=C3C)O)OC
Kasanosin c
Names
-
Mycotoxin name: Kasanosin c
-
First synonym: Kasanosin c
-
Synonyms: Kasanosin C,ZINC96111522
Identifiers / External links
-
CAS: 1268451-58-6
-
PubChem CID: 97423573
-
ChemSpiderID: 78437526
-
Chemical Entities of Biological Interest (CHEBI): CHEBI:214918
Structure
-
Smiles: CC=CC1=CC2=C(CO1)C(=O)C(C(C2)O)(C)OC(=O)C3=C(C=C(C=C3C)O)OC
-
Isomeric smiles: C/C=C/C1=CC2=C(CO1)C(=O)[C@@]([C@H](C2)O)(C)OC(=O)C3=C(C=C(C=C3C)O)OC
-
Inchi: InChI=1S/C22H24O7/c1-5-6-15-8-13-9-18(24)22(3,20(25)16(13)11-28-15)29-21(26)19-12(2)7-14(23)10-17(19)27-4/h5-8,10,18,23-24H,9,11H2,1-4H3/b6-5+/t18-,22-/m0/s1
-
Inchikey: KFFKMHLZUAKCOH-IHMXKHASSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C22H24O7
-
Molecular weight: 400.40
-
Monoisotopic mass: 400.1522031
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 1128 Talaromyces sp.T1BF