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(Q82946057)
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Sialic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
309.105981188
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₉NO₉
0 references
canonical SMILES
O=C(O)C1(O)OC(C(O)C(O)CO)C(NC(=O)C)C(O)C1
0 references
found in taxon
Escherichia coli
1 reference
stated in
A comprehensive genome-scale reconstruction of Escherichia coli metabolism--2011.
Homo sapiens
1 reference
stated in
A community-driven global reconstruction of human metabolism.
Identifiers
InChI
InChI=1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)
0 references
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
0 references
CAS Registry Number
489-46-3
0 references
PubChem CID
906
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
47135
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN_ReSpect-PS047401
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PS047407
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PS047408
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PS047409
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PS047410
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PS047411
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PT204740
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_ReSpect-PS047402
1 reference
InChIKey
SQVRNKJHWKZAKO-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
DSSTox substance ID
DTXSID80964136
0 references
DSSTOX compound identifier
DTXCID40198935
0 references
NSC number
111756
0 references
Human Metabolome Database ID
HMDB0246275
1 reference
based on heuristic
inferred from InChIKey
Probes And Drugs ID
PD055760
0 references
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