AB00824
17833-43-1 | 4-Methylumbelliferyl alpha-d-glucopyranoside
Manufacturer: A2B Chem
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CatalogNumber
AB00824
ChemicalName
4-Methylumbelliferyl alpha-d-glucopyranoside
CasNumber
17833-43-1
MolecularFormula
C16H18O8
MolecularWeight
338.3093
MdlNumber
MFCD00067661
Smiles
OC[C@H]1O[C@H](Oc2ccc3c(c2)oc(=O)cc3C)[C@@H]([C@H]([C@@H]1O)O)O
Complexity
506
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
5
HeavyAtomCount
24
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
4
RotatableBondCount
3
Xlogp3
-0.8
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CatalogNumber: AB00824
ChemicalName: 4-Methylumbelliferyl alpha-d-glucopyranoside
CasNumber: 17833-43-1
MolecularFormula: C16H18O8
MolecularWeight: 338.3093
MdlNumber: MFCD00067661
Smiles: OC[C@H]1O[C@H](Oc2ccc3c(c2)oc(=O)cc3C)[C@@H]([C@H]([C@@H]1O)O)O
Complexity: 506
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 5
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 4
RotatableBondCount: 3
Xlogp3: -0.8
CatalogNumber:
AB00824
ChemicalName:
4-Methylumbelliferyl alpha-d-glucopyranoside
CasNumber:
17833-43-1
MolecularFormula:
C16H18O8
MolecularWeight:
338.3093
MdlNumber:
MFCD00067661
Smiles:
OC[C@H]1O[C@H](Oc2ccc3c(c2)oc(=O)cc3C)[C@@H]([C@H]([C@@H]1O)O)O
Complexity:
506
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
5
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
4
RotatableBondCount:
3
Xlogp3:
-0.8
CatalogNumber: __
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Smiles: OCCCCOC=C
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Smiles:
OCCCCOC=C
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Smiles: C=CCOC(=O)c1cc(cc(c1)C(=O)OCC=C)C(=O)OCC=C
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Smiles:
C=CCOC(=O)c1cc(cc(c1)C(=O)OCC=C)C(=O)OCC=C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
__
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Smiles: Oc1ccc2c(c1)[nH]c(n2)Br
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
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HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Oc1ccc2c(c1)[nH]c(n2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__