fumiquinazoline g
-
Formula: C21H18N4O2
-
Molecular weight: 358.40
-
Smiles: CC1C2=NC3=CC=CC=C3C(=O)N2C(C(=O)N1)CC4=CNC5=CC=CC=C54
-
Type: Pyrazinoquinazoline
fumiquinazoline g
Names
-
Mycotoxin name: fumiquinazoline g
-
First synonym: None
-
Synonyms: FUMIQUINAZOLINE G,(1R,4R)-4-(1H-indol-3-ylmethyl)-1-methyl-2,4-dihydro-1H-pyrazino(2,1-b)quinazoline-3,6-dione,(1R,4R)-4-(1H-indol-3-ylmethyl)-1-methyl-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione,CHEMBL2229118,SCHEMBL23023416,169869-87-8
Identifiers / External links
-
CAS: 169869-87-8
-
PubChem CID: 10247811
-
ChemSpiderID: 10216894
-
ChEMBL: CHEMBL23023416,CHEMBL2229118
-
SCHEMBL: SCHEMBL23023416
Structure
-
Smiles: CC1C2=NC3=CC=CC=C3C(=O)N2C(C(=O)N1)CC4=CNC5=CC=CC=C54
-
Isomeric smiles: C[C@@H]1C2=NC3=CC=CC=C3C(=O)N2[C@@H](C(=O)N1)CC4=CNC5=CC=CC=C54
-
Inchi: InChI=1S/C21H18N4O2/c1-12-19-24-17-9-5-3-7-15(17)21(27)25(19)18(20(26)23-12)10-13-11-22-16-8-4-2-6-14(13)16/h2-9,11-12,18,22H,10H2,1H3,(H,23,26)/t12-,18-/m1/s1
-
Inchikey: SUVZUTHVKIBYOH-KZULUSFZSA-N
-
2D structure:
-
3D structure:
Physico-chemical properties
-
Formula: C21H18N4O2
-
Molecular weight: 358.40
-
Monoisotopic mass: 358.14297583
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 134 Aspergillus fumigatus 168 Aspergillus lentulus 277 Aspergillus udagawae