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English
2-Acetamido-2-deoxy-D-talopyranose
chemical compound
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No label defined
No description defined
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Statements
instance of
group of stereoisomers
0 references
subclass of
N-acetyl-D-hexosamine
1 reference
based on heuristic
inferred from SMILES
mass
221.0899372
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₈H₁₅NO₆
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(O)=NC1C(O)OC(CO)C(O)C1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC(=O)N[C@@H]1C(O)O[C@H](CO)[C@H](O)[C@@H]1O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6+,7-,8?/m1/s1
0 references
InChIKey
OVRNDRQMDRJTHS-XLSKCSLXSA-N
0 references
CAS Registry Number
282727-46-2
0 references
PubChem CID
57376616
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
OVRNDRQMDRJTHS-XLSKCSLXSA-N
ChEBI ID
182169
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6+,7-,8?/m1/s1
SureChEMBL ID
SCHEMBL22748805
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OVRNDRQMDRJTHS-XLSKCSLXSA-N
UniChem compound ID
62038072
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80725229
1 reference
matched by identifier from
InChIKey
InChIKey
OVRNDRQMDRJTHS-XLSKCSLXSA-N
DSSTOX compound identifier
DTXCID00675974
0 references
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