AB05941
20513-98-8 | D-Glucurono-6,3-lactone acetonide
Manufacturer: A2B Chem
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CatalogNumber
AB05941
ChemicalName
D-Glucurono-6,3-lactone acetonide
CasNumber
20513-98-8
MolecularFormula
C9H12O6
MolecularWeight
216.188
MdlNumber
MFCD01863407
Smiles
O[C@@H]1C(=O)O[C@H]2[C@@H]1O[C@H]1[C@@H]2OC(O1)(C)C
Complexity
314
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
5
HeavyAtomCount
15
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
Xlogp3
-0.5
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CatalogNumber: AB05941
ChemicalName: D-Glucurono-6,3-lactone acetonide
CasNumber: 20513-98-8
MolecularFormula: C9H12O6
MolecularWeight: 216.188
MdlNumber: MFCD01863407
Smiles: O[C@@H]1C(=O)O[C@H]2[C@@H]1O[C@H]1[C@@H]2OC(O1)(C)C
Complexity: 314
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 5
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
Xlogp3: -0.5
CatalogNumber:
AB05941
ChemicalName:
D-Glucurono-6,3-lactone acetonide
CasNumber:
20513-98-8
MolecularFormula:
C9H12O6
MolecularWeight:
216.188
MdlNumber:
MFCD01863407
Smiles:
O[C@@H]1C(=O)O[C@H]2[C@@H]1O[C@H]1[C@@H]2OC(O1)(C)C
Complexity:
314
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
5
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
Xlogp3:
-0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: Cc1ccc(cc1)S(=O)(=O)OC[C@H]1O[C@H]2[C@@H]([C@H]1O)OC(O2)(C)C
Complexity: __
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Smiles:
Cc1ccc(cc1)S(=O)(=O)OC[C@H]1O[C@H]2[C@@H]([C@H]1O)OC(O2)(C)C
Complexity:
__
Covalently-bondedUnitCount:
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Smiles: CCCCCCCCCCCCCCCC1=NCCN1CCN
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Smiles:
CCCCCCCCCCCCCCCC1=NCCN1CCN
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Smiles: Oc1ccc2c(c1)[nH]c(=O)cc2C
Complexity: __
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HydrogenBondAcceptorCount: __
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Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
Oc1ccc2c(c1)[nH]c(=O)cc2C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__