AD34784
40591-65-9 | 2-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-2-thiopseudourea hydrobromide
Manufacturer: A2B Chem
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CatalogNumber
AD34784
ChemicalName
2-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-2-thiopseudourea hydrobromide
CasNumber
40591-65-9
MolecularFormula
C15H23BrN2O9S
MolecularWeight
487.3201
MdlNumber
MFCD00058238
Smiles
CC(=O)OCC1OC(SC(=N)N)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C.Br
Complexity
612
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
5
HeavyAtomCount
28
HydrogenBondAcceptorCount
11
HydrogenBondDonorCount
3
RotatableBondCount
11
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CatalogNumber: AD34784
ChemicalName: 2-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-2-thiopseudourea hydrobromide
CasNumber: 40591-65-9
MolecularFormula: C15H23BrN2O9S
MolecularWeight: 487.3201
MdlNumber: MFCD00058238
Smiles: CC(=O)OCC1OC(SC(=N)N)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C.Br
Complexity: 612
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 5
HeavyAtomCount: 28
HydrogenBondAcceptorCount: 11
HydrogenBondDonorCount: 3
RotatableBondCount: 11
CatalogNumber:
AD34784
ChemicalName:
2-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-2-thiopseudourea hydrobromide
CasNumber:
40591-65-9
MolecularFormula:
C15H23BrN2O9S
MolecularWeight:
487.3201
MdlNumber:
MFCD00058238
Smiles:
CC(=O)OCC1OC(SC(=N)N)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C.Br
Complexity:
612
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
5
HeavyAtomCount:
28
HydrogenBondAcceptorCount:
11
HydrogenBondDonorCount:
3
RotatableBondCount:
11
CatalogNumber: __
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CasNumber: __
MolecularFormula: __
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Smiles: CC(=O)C1CC2CCC1C=C2
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Smiles:
CC(=O)C1CC2CCC1C=C2
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Smiles: Fc1ccc(cc1)C=Cc1ccc(cc1)N(C)C
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Smiles:
Fc1ccc(cc1)C=Cc1ccc(cc1)N(C)C
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Smiles: O=CC(C=C=C(C)C)(C)C
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MolecularFormula:
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Smiles:
O=CC(C=C=C(C)C)(C)C
Complexity:
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Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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