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4-Ethyloctanoic acid

PropertiesImage
MNX_IDMNXM117894 Image of MNXM117894
referencechebi:179551
formulaC10H20O2
global charge0
mol weight172.268
InChIKeyPWKJMPFEQOHBAC-UHFFFAOYSA-N
InChIInChI=1S/C10H20O2/c1-3-5-6-9(4-2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)
SMILESCCCCC(CC)CCC(=O)O
MNX internals
InChI (mnx)InChI=1/C10H20O2/c1-3-5-6-9(4-2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)/t9? Image of MNXM117894
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:6][CH:9]([CH2:4][CH3:2])[CH2:7][CH2:8][C:10](=[O:11])[OH:12]
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:179551
chebi:179551
PWKJMPFEQOHBAC-UHFFFAOYSA-N
4-Ethyloctanoic acid
4-ethyloctanoic acid
hmdb:HMDB0036136
PWKJMPFEQOHBAC-UHFFFAOYSA-N
4-Ethyloctanoic acid
4-Ethyloctanoate
4-ethyloctanoic acid
FEMA 3800

lipidmaps:LMFA01030983
lipidmapsM:LMFA01030983
PWKJMPFEQOHBAC-UHFFFAOYSA-N
4-Ethyloctanoic acid
4-ethyloctanoic acid
FA 10:0

metacyc.compound:CPD-21106
metacycM:CPD-21106
seed.compound:cpd35519
seedM:cpd35519
PWKJMPFEQOHBAC-UHFFFAOYSA-M
4-ethyloctanoate

hmdb:HMDB36136
seedM:M_cpd35519
secondary/obsolete/fantasy identifier