Oudemansin X
-
Formula: C18H24O5
-
Molecular weight: 320.40
-
Smiles: CC(C(C=CC1=CC=C(C=C1)OC)OC)C(=COC)C(=O)OC
Oudemansin X
Names
-
Mycotoxin name: Oudemansin X
-
First synonym: None
-
Synonyms: Oudemansin X,130640-32-3,methyl (E,2E,3S,4S)-4-methoxy-2-(methoxymethylidene)-6-(4-methoxyphenyl)-3-methylhex-5-enoate,5-Hexenoic acid, 4-methoxy-2-(methoxymethylene)-6-(4-methoxyphenyl)-3-methyl-, methyl ester, (S-(R*,R*-(E,E)))-
Structure
-
Smiles: CC(C(C=CC1=CC=C(C=C1)OC)OC)C(=COC)C(=O)OC
-
Isomeric smiles: C[C@H]([C@H](/C=C/C1=CC=C(C=C1)OC)OC)/C(=C\OC)/C(=O)OC
-
Inchi: InChI=1S/C18H24O5/c1-13(16(12-20-2)18(19)23-5)17(22-4)11-8-14-6-9-15(21-3)10-7-14/h6-13,17H,1-5H3/b11-8+,16-12+/t13-,17-/m0/s1
-
Inchikey: PGQAMCDKTUKRQA-JDKRGPGZSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C18H24O5
-
Molecular weight: 320.40
-
Monoisotopic mass: 320.16237386
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 702 Oudemansiella radicata No. 86125