AA88289
16564-43-5 | Glycochenodeoxycholic acid sodium salt
Manufacturer: A2B Chem
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CatalogNumber
AA88289
ChemicalName
Glycochenodeoxycholic acid sodium salt
CasNumber
16564-43-5
MolecularFormula
C26H42NNaO5
MolecularWeight
471.6051
MdlNumber
MFCD00036743
Smiles
O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCC(=O)[O-])C)C)O)C.[Na+]
Complexity
734
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
10
HeavyAtomCount
33
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
6
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CatalogNumber: AA88289
ChemicalName: Glycochenodeoxycholic acid sodium salt
CasNumber: 16564-43-5
MolecularFormula: C26H42NNaO5
MolecularWeight: 471.6051
MdlNumber: MFCD00036743
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCC(=O)[O-])C)C)O)C.[Na+]
Complexity: 734
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 10
HeavyAtomCount: 33
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 6
CatalogNumber:
AA88289
ChemicalName:
Glycochenodeoxycholic acid sodium salt
CasNumber:
16564-43-5
MolecularFormula:
C26H42NNaO5
MolecularWeight:
471.6051
MdlNumber:
MFCD00036743
Smiles:
O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCC(=O)[O-])C)C)O)C.[Na+]
Complexity:
734
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
10
HeavyAtomCount:
33
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
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Smiles: CC([N+](C(C)C)(CCC(c1ccccc1)(c1ccccc1)C(=O)N)C)C.[Br-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CC([N+](C(C)C)(CCC(c1ccccc1)(c1ccccc1)C(=O)N)C)C.[Br-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC1(O)COC1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
OCC1(O)COC1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCCOc1cccc2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCCOc1cccc2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__