MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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4-Methyl-4-hydroxypentanal
Properties
Image
Occurences in reactions
MNX_ID
MNXM166409
#reac
in my sandbox
0
in MNXref (generic)
1
in models (compartimentalized)
0
formula
C
6
H
12
O
2
charge
0
mass
116.08373
reference
sabiorkM:25443
InChIKey
SOKUNMXCTFSODA-ONEGZZNKSA-N
InChI
InChI=1S/C6H12O2/c1-6(2,8)4-3-5-7/h3-4,7-8H,5H2,1-2H3/b4-3+
SMILES
CC(C)(O)/C=C/CO
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
sabiork.compound:25443
sabiorkM:25443
4-Methyl-4-hydroxypentanal
(2E)-4-Methyl-2-pentene-1,4-diol