Results for:
PubChem ID: 400838

[2,3-diacetyloxy-3-(1-phenylpyrazolo[4,3-b]quinoxalin-3-yl)propyl] Acetate

Compound Details

Synonymous names	NSC713358 HDNQAKKTCNJTOK-UHFFFAOYSA-N NSC-713358 1,2,3-Propanetriol, 1-(1-phenyl-1H-pyrazolo[3,4-b]quinoxalin-3-yl)-, triacetate (ester), [S-(R*,S*)]- 2-(Acetyloxy)-1-[(acetyloxy)methyl]-2-(1-phenyl-1H-pyrazolo[3,4-b]quinoxalin-3-yl)ethyl acetate #
Microorganism:	No
IUPAC name	[2,3-diacetyloxy-3-(1-phenylpyrazolo[4,3-b]quinoxalin-3-yl)propyl] acetate
SMILES	CC(=O)OCC(C(C1=NN(C2=NC3=CC=CC=C3N=C12)C4=CC=CC=C4)OC(=O)C)OC(=O)C
Inchi	InChI=1S/C24H22N4O6/c1-14(29)32-13-20(33-15(2)30)23(34-16(3)31)21-22-24(26-19-12-8-7-11-18(19)25-22)28(27-21)17-9-5-4-6-10-17/h4-12,20,23H,13H2,1-3H3
Formula	C24H22N4O6
PubChem ID	400838
Molweight	462.5
LogP	2.5
Atoms	34
Bonds	10
H-bond Acceptor	9
H-bond Donor	0
Chemical Classification	aromatic compounds benzenoids esters nitrogen compounds pyrazoles quinoxalines

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Aspergillus Niger Kate et al. 2023
Method	Kingdom Species Growth Medium Applied Method Verification Aspergillus Niger inoculated potato samples GC-MS no