AE12808
117997-81-6 | Boc-DL-Glu(Obzl)-OH
Manufacturer: A2B Chem
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CatalogNumber
AE12808
ChemicalName
Boc-DL-Glu(Obzl)-OH
CasNumber
117997-81-6
MolecularFormula
C17H23NO6
MolecularWeight
337.3676
MdlNumber
MFCD00798612
Smiles
O=C(OCc1ccccc1)CCC(C(=O)O)NC(=O)OC(C)(C)C
Complexity
437
Covalently-bondedUnitCount
1
HeavyAtomCount
24
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
2
RotatableBondCount
10
UndefinedAtomStereocenterCount
1
Xlogp3
2.2
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CatalogNumber: AE12808
ChemicalName: Boc-DL-Glu(Obzl)-OH
CasNumber: 117997-81-6
MolecularFormula: C17H23NO6
MolecularWeight: 337.3676
MdlNumber: MFCD00798612
Smiles: O=C(OCc1ccccc1)CCC(C(=O)O)NC(=O)OC(C)(C)C
Complexity: 437
Covalently-bondedUnitCount: 1
HeavyAtomCount: 24
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 10
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.2
CatalogNumber:
AE12808
ChemicalName:
Boc-DL-Glu(Obzl)-OH
CasNumber:
117997-81-6
MolecularFormula:
C17H23NO6
MolecularWeight:
337.3676
MdlNumber:
MFCD00798612
Smiles:
O=C(OCc1ccccc1)CCC(C(=O)O)NC(=O)OC(C)(C)C
Complexity:
437
Covalently-bondedUnitCount:
1
HeavyAtomCount:
24
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
10
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.2
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Smiles: C[N+]1(CCCC1)CC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)[O-].OS(=O)(=O)O
Complexity: __
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Smiles:
C[N+]1(CCCC1)CC2=C(N3C(C(C3=O)NC(=O)C(=NOC)C4=CSC(=N4)N)SC2)C(=O)[O-].OS(=O)(=O)O
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Smiles: OCCOc1cc(OC2OC(COC3OC(C)C(C(C3O)O)O)C(C(C2O)O)O)cc2c1c(=O)cc(o2)c1ccc(c(c1)O)OC
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
OCCOc1cc(OC2OC(COC3OC(C)C(C(C3O)O)O)C(C(C2O)O)O)cc2c1c(=O)cc(o2)c1ccc(c(c1)O)OC
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
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