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(Q60662693)
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English
DL-isoleucine
A 2-amino-3-methylpentanoic acid having either D- or L-configuration.
isoleucine
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Statements
instance of
group of stereoisomers
0 references
subclass of
amino fatty acids
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L-amino acid
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essential amino acid
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proteinogenic amino acid
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amino acid
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branched-chain amino acid
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D-amino acid
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part of
isoleucine metabolic process
subject has role
participant
1 reference
stated in
Gene Ontology release 2019-11-16
isoleucine catabolic process
subject has role
reactant
1 reference
stated in
Gene Ontology release 2019-11-16
isoleucine biosynthetic process
subject has role
product
1 reference
stated in
Gene Ontology release 2019-11-16
isoleucine transmembrane transport
subject has role
cargo
1 reference
stated in
Gene Ontology release 2019-11-16
isoleucine transport
subject has role
cargo
1 reference
stated in
Gene Ontology release 2019-11-16
mass
131.094628656
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₆H₁₃NO₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC[CH](C)[CH](N)C(O)=O
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Identifiers
InChI
InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
1 reference
based on heuristic
inferred from SMILES
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
1 reference
based on heuristic
inferred from InChI
PubChem CID
791
1 reference
matched by identifier from
InChIKey
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
57397079
1 reference
matched by identifier from
InChIKey
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
ChEBI ID
24898
0 references
38264
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)
SureChEMBL ID
SCHEMBL8868
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
NMRShiftDB structure ID
10016958
1 reference
matched by identifier from
InChIKey
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
DSSTox substance ID
DTXSID80901480
1 reference
matched by identifier from
InChIKey
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0033923
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AGPKZVBTJJNPAG-UHFFFAOYSA-N
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