AC64818
67416-61-9 | AKBA
Manufacturer: A2B Chem
The price for this product is unavailable. Please request a quote
CatalogNumber
AC64818
ChemicalName
AKBA
CasNumber
67416-61-9
MolecularFormula
C32H48O5
MolecularWeight
512.7205
MdlNumber
MFCD03788777
Smiles
CC(=O)OC1CCC2(C(C1(C)C(=O)O)CCC1(C2C(=O)C=C2C1(C)CCC1(C2C(C)C(C)CC1)C)C)C
Complexity
1060
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
11
HeavyAtomCount
37
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
7.2
Related Products
Compare Similar Items
Show Difference
CatalogNumber: AC64818
ChemicalName: AKBA
CasNumber: 67416-61-9
MolecularFormula: C32H48O5
MolecularWeight: 512.7205
MdlNumber: MFCD03788777
Smiles: CC(=O)OC1CCC2(C(C1(C)C(=O)O)CCC1(C2C(=O)C=C2C1(C)CCC1(C2C(C)C(C)CC1)C)C)C
Complexity: 1060
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 11
HeavyAtomCount: 37
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 7.2
CatalogNumber:
AC64818
ChemicalName:
AKBA
CasNumber:
67416-61-9
MolecularFormula:
C32H48O5
MolecularWeight:
512.7205
MdlNumber:
MFCD03788777
Smiles:
CC(=O)OC1CCC2(C(C1(C)C(=O)O)CCC1(C2C(=O)C=C2C1(C)CCC1(C2C(C)C(C)CC1)C)C)C
Complexity:
1060
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
11
HeavyAtomCount:
37
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
7.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=c1[nH]c(=O)n2c([nH]1)ncc2
Complexity: 217
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: -0.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=c1[nH]c(=O)n2c([nH]1)ncc2
Complexity:
217
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
-0.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(c(c1)C)C(=O)CCC(=O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(c(c1)C)C(=O)CCC(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O.[Na].[Na].[Na].[Na]
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O.[Na].[Na].[Na].[Na]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__