AB72438
57-48-7 | D-(-)-Fructose
Manufacturer: A2B Chem
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CatalogNumber
AB72438
ChemicalName
D-(-)-Fructose
CasNumber
57-48-7
MolecularFormula
C6H12O6
MolecularWeight
180.15587999999997
MdlNumber
MFCD00148910
Smiles
OC[C@H]([C@H]([C@@H](C(=O)CO)O)O)O
Complexity
147
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
3
HeavyAtomCount
12
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
5
RotatableBondCount
5
Xlogp3
-3.2
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CatalogNumber: AB72438
ChemicalName: D-(-)-Fructose
CasNumber: 57-48-7
MolecularFormula: C6H12O6
MolecularWeight: 180.15587999999997
MdlNumber: MFCD00148910
Smiles: OC[C@H]([C@H]([C@@H](C(=O)CO)O)O)O
Complexity: 147
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 3
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 5
RotatableBondCount: 5
Xlogp3: -3.2
CatalogNumber:
AB72438
ChemicalName:
D-(-)-Fructose
CasNumber:
57-48-7
MolecularFormula:
C6H12O6
MolecularWeight:
180.15587999999997
MdlNumber:
MFCD00148910
Smiles:
OC[C@H]([C@H]([C@@H](C(=O)CO)O)O)O
Complexity:
147
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
3
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
5
RotatableBondCount:
5
Xlogp3:
-3.2
CatalogNumber: AB72439
ChemicalName: D-Lactic acid
CasNumber: 10326-41-7
MolecularFormula: C3H6O3
MolecularWeight: 90.0779
MdlNumber: MFCD00068311
Smiles: OC(=O)[C@H](O)C
Complexity: 59.1
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 6
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: -0.7
CatalogNumber:
AB72439
ChemicalName:
D-Lactic acid
CasNumber:
10326-41-7
MolecularFormula:
C3H6O3
MolecularWeight:
90.0779
MdlNumber:
MFCD00068311
Smiles:
OC(=O)[C@H](O)C
Complexity:
59.1
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
6
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
-0.7
CatalogNumber: AB72440
ChemicalName: (R)-(-)-Methyl mandelate
CasNumber: 20698-91-3
MolecularFormula: C9H10O3
MolecularWeight: 166.1739
MdlNumber: MFCD00064247
Smiles: COC(=O)[C@@H](c1ccccc1)O
Complexity: 150
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.2
CatalogNumber:
AB72440
ChemicalName:
(R)-(-)-Methyl mandelate
CasNumber:
20698-91-3
MolecularFormula:
C9H10O3
MolecularWeight:
166.1739
MdlNumber:
MFCD00064247
Smiles:
COC(=O)[C@@H](c1ccccc1)O
Complexity:
150
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@@H]([C@@H](C(=O)O)O)C(=O)O
Complexity: 134
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@@H]([C@@H](C(=O)O)O)C(=O)O
Complexity:
134
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-1.9