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6-acetamido-3-oxohexanoate

PropertiesImage
MNX_IDMNXM4412 Image of MNXM4412
referencechebi:17982
formulaC8H12NO4
global charge-1
mol weight186.187
InChIKeyGICCYAKQXAHHKY-UHFFFAOYSA-M
InChIInChI=1S/C8H13NO4/c1-6(10)9-4-2-3-7(11)5-8(12)13/h2-5H2,1H3,(H,9,10)(H,12,13)/p-1
SMILESCC(=O)NCCCC(=O)CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C8H13NO4/c1-6(10)9-4-2-3-7(11)5-8(12)13/h2-5H2,1H3,(H,9,10)(H,12,13) Image of MNXM4412
SMILES (mnx)[CH3:1][C:6](=[N:9][CH2:4][CH2:2][CH2:3][C:7]([CH2:5][C:8](=[O:12])[OH:13])=[O:11])[OH:10]
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:17982
chebi:17982
GICCYAKQXAHHKY-UHFFFAOYSA-M
6-acetamido-3-oxohexanoate

metacyc.compound:3-OXO-6-ACETAMIDOHEXANOATE
metacycM:3-OXO-6-ACETAMIDOHEXANOATE
GICCYAKQXAHHKY-UHFFFAOYSA-M
3-oxo-6-acetamidohexanoate
6-acetamido-3-oxohexanoate

kegg.compound:C03682
keggC:C03682
GICCYAKQXAHHKY-UHFFFAOYSA-N
6-Acetamido-3-oxohexanoate

seed.compound:cpd02313
seedM:cpd02313
GICCYAKQXAHHKY-UHFFFAOYSA-M
6-Acetamido-3-oxohexanoate
3-oxo-6-acetamidohexanoate
6-acetamido-3-oxohexanoate

CHEBI:2165
chebi:2165
GICCYAKQXAHHKY-UHFFFAOYSA-N
6-acetamido-3-oxohexanoic acid
3-keto-6-acetamidohexanoate
3-oxo-6-acetamidohexanoic acid
6-Acetamido-3-oxohexanoate
6-acetamido-3-ketohexanoic acid

chebi:12203
chebi:20154
chebi:20692
keggC:M_C03682
seedM:M_cpd02313
secondary/obsolete/fantasy identifier