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English
L-isoleucine zwitterion
chemical compound
(2S,3S)-2-azaniumyl-3-methylpentanoate
In more languages
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
part of
isoleucine-tRNA ligase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
valine-3-methyl-2-oxovalerate transaminase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
isoleucine N-monooxygenase (oxime forming) activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
L-isoleucine transaminase activity
1 reference
reference URL
http://geneontology.org/external2go/rhea2go
retrieved
1 February 2021
L-isoleucine transmembrane transporter activity
subject has role
cargo
1 reference
stated in
Gene Ontology release 2022-07-01
L-isoleucine biosynthetic process
subject has role
product
1 reference
stated in
Gene Ontology release 2022-07-01
mass
131.094628656
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
L-allo-Isoleucine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
L-isoleucine
1 reference
based on heuristic
inferred from InChI
D-isoleucine
1 reference
based on heuristic
inferred from InChI
D-alloisoleucine
1 reference
based on heuristic
inferred from InChI
tautomer of
L-isoleucine
1 reference
stated in
ChEBI release 2021-03-01
chemical formula
C₆H₁₃NO₂
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCC(C)C(N)C(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC[C@H](C)[C@H](N)C(=O)O
1 reference
based on heuristic
inferred from InChI
subject has role
primary metabolite
1 reference
stated in
Reactome
reference URL
https://reactome.org/PathwayBrowser/#/R-HSA-1430728&DTAB=MT
Identifiers
InChI
InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
1 reference
stated in
ChEBI release 2021-03-01
CAS Registry Number
34464-35-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
443-79-8
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
73-32-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
ChEBI ID
58045
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
MassBank accession ID
MSBNK-BGC_Munich-RP000801
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-BGC_Munich-RP000802
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-BGC_Munich-RP000803
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-BGC_Munich-RP000811
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-GL_Sciences_Inc-GLS00013
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-NAIST-KNA00041
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-NAIST-KNA00043
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-NAIST-KNA00320
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Osaka_Univ-OUF00312
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Kazusa-KZ000231
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO001176
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO001179
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO001175
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO003172
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO003173
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO003176
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Kazusa-KZ000232
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Kazusa-KZ000233
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO001177
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO003174
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO001178
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Keio_Univ-KO003175
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-Osaka_Univ-OUF01004
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR010061
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR030010
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-NAIST-KNA00042
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-NAIST-KNA00321
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-NAIST-KNA00322
1 reference
InChIKey
AGPKZVBTJJNPAG-WHFBIAKZSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
Cannabis Database ID
000132
1 reference
stated in
Cannabis Database
Human Metabolome Database ID
HMDB0000172
1 reference
based on heuristic
inferred from InChIKey
Probes And Drugs ID
PD010191
0 references
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