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2-Amino-2-deoxy-D-glucopyranose
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
D-glucosamine
1 reference
based on heuristic
inferred from SMILES
mass
179.079372516
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
D-β-glucosamine
1 reference
based on heuristic
inferred from InChI
D-α-glucosamine
1 reference
based on heuristic
inferred from InChI
2-amino-2-deoxy-β-D-mannopyranose
1 reference
based on heuristic
inferred from InChI
2-amino-2-deoxy-α-D-mannopyranose
1 reference
based on heuristic
inferred from InChI
2-amino-2-deoxy-β-D-galactopyranose
1 reference
based on heuristic
inferred from InChI
2-amino-2-deoxy-α-D-galactopyranose
1 reference
based on heuristic
inferred from InChI
chemical formula
C₆H₁₃NO₅
0 references
canonical SMILES
NC1C(O)OC(CO)C(O)C1O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6-/m1/s1
0 references
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
1 reference
based on heuristic
inferred from InChI
CAS Registry Number
90-77-7
0 references
PubChem CID
441477
1 reference
matched by identifier from
InChIKey
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
ChEBI ID
28393
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6-/m1/s1
SureChEMBL ID
SCHEMBL3263
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
NMRShiftDB structure ID
20213218
1 reference
matched by identifier from
InChIKey
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
DSSTox substance ID
DTXSID601347914
1 reference
matched by identifier from
InChIKey
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
Human Metabolome Database ID
HMDB0030091
1 reference
matched by identifier from
InChIKey
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
UNII
58L064K8RR
1 reference
matched by identifier from
InChIKey
InChIKey
MSWZFWKMSRAUBD-QZABAPFNSA-N
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