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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:27713 - (5
S
)-5-amino-3-oxohexanoic acid
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ChEBI Name
(5
S
)-5-amino-3-oxohexanoic acid
ChEBI ID
CHEBI:27713
ChEBI ASCII Name
(5S)-5-amino-3-oxohexanoic acid
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:18761, CHEBI:408, CHEBI:11054
Supplier Information
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Molfile
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Molfile
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Formula
C6H11NO3
Net Charge
0
Average Mass
145.158
Monoisotopic Mass
145.07389
InChI
InChI=1S/C6H11NO3/c1-4(7)2-5(8)3-6(9)10/h4H,2-3,7H2,1H3,(H,9,10)/t4-/m0/s1
InChIKey
FAASBXNEOGMQHS-BYPYZUCNSA-N
SMILES
C(CC(C[C@H](C)N)=O)(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(5
S
)-5-amino-3-oxohexanoic acid (
CHEBI:27713
)
has functional parent
hexanoic acid (
CHEBI:30776
)
(5
S
)-5-amino-3-oxohexanoic acid (
CHEBI:27713
)
is a
δ-amino acid (
CHEBI:35931
)
(5
S
)-5-amino-3-oxohexanoic acid (
CHEBI:27713
)
is a
3-oxo monocarboxylic acid (
CHEBI:47881
)
(5
S
)-5-amino-3-oxohexanoic acid (
CHEBI:27713
)
is tautomer of
(5
S
)-5-amino-3-oxohexanoic acid zwitterion (
CHEBI:58523
)
Incoming
(5
S
)-5-amino-3-oxohexanoic acid zwitterion (
CHEBI:58523
)
is tautomer of
(5
S
)-5-amino-3-oxohexanoic acid (
CHEBI:27713
)
IUPAC Name
(5
S
)-5-amino-3-oxohexanoic acid
Synonyms
Sources
(S)-5-Amino-3-oxohexanoate
KEGG COMPOUND
(S)-5-amino-3-oxohexanoate
ChEBI
(S)-5-Amino-3-oxohexanoate
KEGG COMPOUND
Manual Xrefs
Databases
C03656
KEGG COMPOUND
KMH
PDBeChem
LMFA01060173
LIPID MAPS
View more database links
Last Modified
21 November 2019