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6-oxo-famciclovir

PropertiesImage
MNX_IDMNXM151500 Image of MNXM151500
referencechebi:196591
formulaC14H19N5O5
global charge0
mol weight337.336
InChIKeyKQURMIWGELPUHQ-UHFFFAOYSA-N
InChIInChI=1S/C14H19N5O5/c1-8(20)23-5-10(6-24-9(2)21)3-4-19-7-16-11-12(19)17-14(15)18-13(11)22/h7,10H,3-6H2,1-2H3,(H3,15,17,18,22)
SMILESCC(=O)OCC(CCN1C=NC2=C1N=C(N)NC2=O)COC(C)=O
MNX internals
InChI (mnx)InChI=1/C14H19N5O5/c1-8(20)23-5-10(6-24-9(2)21)3-4-19-7-16-11-12(19)17-14(15)18-13(11)22/h7,10H,3-6H2,1-2H3,(H3,15,17,18,22) Image of MNXM151500
SMILES (mnx)[CH3:1][C:8](=[O:20])[O:23][CH2:5][CH:10]([CH2:3][CH2:4][N:19]1[CH:7]=[N:16][C:11]2=[C:12]1[NH:17][C:14](=[NH:15])[N:18]=[C:13]2[OH:22])[CH2:6][O:24][C:9]([CH3:2])=[O:21]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:196591
chebi:196591
KQURMIWGELPUHQ-UHFFFAOYSA-N 		6-oxo-famciclovir
[2-(acetyloxymethyl)-4-(2-amino-6-oxo-1H-purin-9-yl)butyl] acetate

sabiork.compound:29928
sabiorkM:29928
KQURMIWGELPUHQ-UHFFFAOYSA-N 		6-Oxo-famciclovir
hmdb:HMDB0061100
KQURMIWGELPUHQ-UHFFFAOYSA-N 		6-oxo-famciclovir
2-[(acetyloxy)methyl]-4-(6-hydroxy-2-imino-3,9-dihydro-2H-purin-9-yl)butyl acetate
2-[(acetyloxy)methyl]-4-(6-hydroxy-2-imino-3H-purin-9-yl)butyl acetate

hmdb:HMDB61100 		secondary/obsolete/fantasy identifier