AE41940
125411-99-6 | (2R,3S,4S,5R,6S)-3,4,5-Tris(benzyloxy)-2-((benzyloxy)methyl)-6-(ethylthio)tetrahydro-2H-pyran
Manufacturer: A2B Chem
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CatalogNumber
AE41940
ChemicalName
(2R,3S,4S,5R,6S)-3,4,5-Tris(benzyloxy)-2-((benzyloxy)methyl)-6-(ethylthio)tetrahydro-2H-pyran
CasNumber
125411-99-6
MolecularFormula
C36H40O5S
MolecularWeight
584.7648
MdlNumber
MFCD13182895
Smiles
CCS[C@@H]1O[C@H](COCc2ccccc2)[C@@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1
Complexity
699
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
5
HeavyAtomCount
42
HydrogenBondAcceptorCount
6
RotatableBondCount
15
Xlogp3
6.7
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CatalogNumber: AE41940
ChemicalName: (2R,3S,4S,5R,6S)-3,4,5-Tris(benzyloxy)-2-((benzyloxy)methyl)-6-(ethylthio)tetrahydro-2H-pyran
CasNumber: 125411-99-6
MolecularFormula: C36H40O5S
MolecularWeight: 584.7648
MdlNumber: MFCD13182895
Smiles: CCS[C@@H]1O[C@H](COCc2ccccc2)[C@@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1
Complexity: 699
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 5
HeavyAtomCount: 42
HydrogenBondAcceptorCount: 6
RotatableBondCount: 15
Xlogp3: 6.7
CatalogNumber:
AE41940
ChemicalName:
(2R,3S,4S,5R,6S)-3,4,5-Tris(benzyloxy)-2-((benzyloxy)methyl)-6-(ethylthio)tetrahydro-2H-pyran
CasNumber:
125411-99-6
MolecularFormula:
C36H40O5S
MolecularWeight:
584.7648
MdlNumber:
MFCD13182895
Smiles:
CCS[C@@H]1O[C@H](COCc2ccccc2)[C@@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)OCc1ccccc1
Complexity:
699
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
5
HeavyAtomCount:
42
HydrogenBondAcceptorCount:
6
RotatableBondCount:
15
Xlogp3:
6.7
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Smiles: CC1(C)C(=CC=CC2=[N+](c3ccccc3)c3c(C2(C)C)cccc3)N(c2c1cccc2)c1ccccc1.[Cl-]
Complexity: __
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Smiles:
CC1(C)C(=CC=CC2=[N+](c3ccccc3)c3c(C2(C)C)cccc3)N(c2c1cccc2)c1ccccc1.[Cl-]
Complexity:
__
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Smiles: [O-]S(=O)(=O)CCCN1c2ccc3c(c2C(C1=CC=CC=CC1=[N+](CCCS(=O)(=O)[O-])c2c(C1(C)C)c1ccccc1cc2)(C)C)cccc3.[Na+]
Complexity: __
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Smiles:
[O-]S(=O)(=O)CCCN1c2ccc3c(c2C(C1=CC=CC=CC1=[N+](CCCS(=O)(=O)[O-])c2c(C1(C)C)c1ccccc1cc2)(C)C)cccc3.[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CCCCCCCCP(=O)(C)C
Complexity: __
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Smiles:
CCCCCCCCP(=O)(C)C
Complexity:
__
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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