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(S)-3-hydroxy-5-oxohexanoate

PropertiesImage
MNX_IDMNXM5523 Image of MNXM5523
referencechebi:231733
formulaC6H9O4
global charge-1
mol weight145.134
InChIKeyAPWDZEIBFNZVND-YFKPBYRVSA-M
InChIInChI=1S/C6H10O4/c1-4(7)2-5(8)3-6(9)10/h5,8H,2-3H2,1H3,(H,9,10)/p-1/t5-/m0/s1
SMILESCC(=O)C[C@H](O)CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C6H10O4/c1-4(7)2-5(8)3-6(9)10/h5,8H,2-3H2,1H3,(H,9,10)/t5-/m0/s1 Image of MNXM5523
SMILES (mnx)[CH3:1][C:4]([CH2:2][C@@H:5]([CH2:3][C:6](=[O:9])[OH:10])[OH:8])=[O:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:231733
chebi:231733
APWDZEIBFNZVND-YFKPBYRVSA-M
(S)-3-hydroxy-5-oxohexanoate

envipath:...d99b9f0d7322
envipathM:...d99b9f0d7322
kegg.compound:C16272
keggC:C16272
vmhM:3h5ohxnt
vmhmetabolite:3h5ohxnt
APWDZEIBFNZVND-UHFFFAOYSA-M
APWDZEIBFNZVND-UHFFFAOYSA-N
3-Hydroxy-5-oxohexanoate

seed.compound:cpd14988
seedM:cpd14988
APWDZEIBFNZVND-UHFFFAOYSA-M
3-Hydroxy-5-oxohexanoate
3-hydroxy-5-oxohexanoate

metacyc.compound:CPD-19
metacycM:CPD-19
APWDZEIBFNZVND-UHFFFAOYSA-M
3-hydroxy-5-oxohexanoate

CHEBI:20051
chebi:20051
APWDZEIBFNZVND-UHFFFAOYSA-M
3-hydroxy-5-oxohexanoate
3-hydroxy-5-ketohexanoate

CHEBI:37032
chebi:37032
APWDZEIBFNZVND-UHFFFAOYSA-N
3-hydroxy-5-oxohexanoic acid
3-Hydroxy-5-ketohexanoic acid

envipath:...0daf99066e22
envipathM:...0daf99066e22
APWDZEIBFNZVND-UHFFFAOYSA-M
compound 0001529

envipath:...6805a4e3f401
envipathM:...6805a4e3f401
APWDZEIBFNZVND-UHFFFAOYSA-M
compound 0285681

keggC:M_C16272
seedM:M_cpd14988
vmhM:M_3h5ohxnt
secondary/obsolete/fantasy identifier