AA96593
1811-31-0 | N-Acetyl-D-galactosamine
Manufacturer: A2B Chem
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CatalogNumber
AA96593
ChemicalName
N-Acetyl-D-galactosamine
CasNumber
1811-31-0
MolecularFormula
C8H15NO6
MolecularWeight
221.2078
MdlNumber
MFCD00135832
Smiles
O=C[C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)NC(=O)C
Complexity
221
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
4
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
5
RotatableBondCount
6
Xlogp3
-3.4
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CatalogNumber: AA96593
ChemicalName: N-Acetyl-D-galactosamine
CasNumber: 1811-31-0
MolecularFormula: C8H15NO6
MolecularWeight: 221.2078
MdlNumber: MFCD00135832
Smiles: O=C[C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)NC(=O)C
Complexity: 221
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 4
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 5
RotatableBondCount: 6
Xlogp3: -3.4
CatalogNumber:
AA96593
ChemicalName:
N-Acetyl-D-galactosamine
CasNumber:
1811-31-0
MolecularFormula:
C8H15NO6
MolecularWeight:
221.2078
MdlNumber:
MFCD00135832
Smiles:
O=C[C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)NC(=O)C
Complexity:
221
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
4
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
5
RotatableBondCount:
6
Xlogp3:
-3.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OS(=O)(=O)O.Nc1ccc2c(c1)nc1c(c2)ccc(c1)N.Nc1ccc2c(c1)nc1c(c2)ccc(c1)N
Complexity: 313
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OS(=O)(=O)O.Nc1ccc2c(c1)nc1c(c2)ccc(c1)N.Nc1ccc2c(c1)nc1c(c2)ccc(c1)N
Complexity:
313
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC(CC=O)(C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC(CC=O)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: ClC(=O)c1ccc(cc1)c1cscc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
ClC(=O)c1ccc(cc1)c1cscc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__