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PubChem ID: 1926333
Methyl (4E)-4-[(3,4-dichlorophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxopyrrole-3-carboxylate
Compound Details
Synonymous names
OLXGNOWLNYTGGA-NTUHNPAUSA-N
4-(3,4-Dichlorobenzylidene)-1-isobutyl-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylic acid, methyl ester
Microorganism:
No
IUPAC name
methyl (4E)-4-[(3,4-dichlorophenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxopyrrole-3-carboxylate
SMILES
CC1=C(C(=CC2=CC(=C(C=C2)Cl)Cl)C(=O)N1CC(C)C)C(=O)OC
Inchi
InChI=1S/C18H19Cl2NO3/c1-10(2)9-21-11(3)16(18(23)24-4)13(17(21)22)7-12-5-6-14(19)15(20)8-12/h5-8,10H,9H2,1-4H3/b13-7+
Formula
C
1
8
H
1
9
Cl
2
NO
3
PubChem ID
1926333
Molweight
368.3
LogP
4.5
Atoms
24
Bonds
5
H-bond Acceptor
3
H-bond Donor
0
Chemical Classification
aromatic compounds
benzenoids
chlorides
esters
halogenated compounds
heterocyclic compounds
nitrogen compounds
mVOC Specific Details
Species emitting the compound
Kingdom
Species
Biological Function
Origin/Habitat
Reference
Aspergillus Flavus
Kate et al. 2023
Method
Kingdom
Species
Growth Medium
Applied Method
Verification
Aspergillus Flavus
inoculated potato samples
GC-MS
no