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1,3-dibutyl-7-(2-oxopropyl)purine-2,6-dione

PropertiesImage
MNX_IDMNXM178707 Image of MNXM178707
referencechebi:92669
formulaC16H24N4O3
global charge0
mol weight320.393
InChIKeyHJPRDDKCXVCFOH-UHFFFAOYSA-N
InChIInChI=1S/C16H24N4O3/c1-4-6-8-19-14-13(18(11-17-14)10-12(3)21)15(22)20(16(19)23)9-7-5-2/h11H,4-10H2,1-3H3
SMILESCCCCN1C(=O)C2=C(N=CN2CC(C)=O)N(CCCC)C1=O
MNX internals
InChI (mnx)InChI=1/C16H24N4O3/c1-4-6-8-19-14-13(18(11-17-14)10-12(3)21)15(22)20(16(19)23)9-7-5-2/h11H,4-10H2,1-3H3 Image of MNXM178707
SMILES (mnx)[CH3:1][CH2:4][CH2:6][CH2:8][N:19]1[C:14]2=[C:13]([C:15](=[O:22])[N:20]([CH2:9][CH2:7][CH2:5][CH3:2])[C:16]1=[O:23])[N:18]([CH2:10][C:12]([CH3:3])=[O:21])[CH:11]=[N:17]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:92669
chebi:92669
HJPRDDKCXVCFOH-UHFFFAOYSA-N
1,3-dibutyl-7-(2-oxopropyl)purine-2,6-dione
hmdb:HMDB0250997
HJPRDDKCXVCFOH-UHFFFAOYSA-N
Denbufylline
1,3-dibutyl-7-(2-oxopropyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
1,3-dibutyl-7-(2-oxopropyl)purine-2,6-dione