AA80960
159351-69-6 | Everolimus
Manufacturer: A2B Chem
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CatalogNumber
AA80960
ChemicalName
Everolimus
CasNumber
159351-69-6
MolecularFormula
C53H83NO14
MolecularWeight
958.2244
MdlNumber
MFCD00929329
Smiles
OCCO[C@@H]1CC[C@H](C[C@H]1OC)C[C@H]([C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H](CC[C@H]2C)C[C@H](OC)C(=CC=CC=C[C@H](C[C@H](C(=O)[C@@H]([C@@H](C(=C[C@H](C(=O)C1)C)C)O)OC)C)C)C)C
Complexity
1810
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
15
DefinedBondStereocenterCount
4
HeavyAtomCount
68
HydrogenBondAcceptorCount
14
HydrogenBondDonorCount
3
RotatableBondCount
9
Xlogp3
5.9
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CatalogNumber: AA80960
ChemicalName: Everolimus
CasNumber: 159351-69-6
MolecularFormula: C53H83NO14
MolecularWeight: 958.2244
MdlNumber: MFCD00929329
Smiles: OCCO[C@@H]1CC[C@H](C[C@H]1OC)C[C@H]([C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H](CC[C@H]2C)C[C@H](OC)C(=CC=CC=C[C@H](C[C@H](C(=O)[C@@H]([C@@H](C(=C[C@H](C(=O)C1)C)C)O)OC)C)C)C)C
Complexity: 1810
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 15
DefinedBondStereocenterCount: 4
HeavyAtomCount: 68
HydrogenBondAcceptorCount: 14
HydrogenBondDonorCount: 3
RotatableBondCount: 9
Xlogp3: 5.9
CatalogNumber:
AA80960
ChemicalName:
Everolimus
CasNumber:
159351-69-6
MolecularFormula:
C53H83NO14
MolecularWeight:
958.2244
MdlNumber:
MFCD00929329
Smiles:
OCCO[C@@H]1CC[C@H](C[C@H]1OC)C[C@H]([C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H](CC[C@H]2C)C[C@H](OC)C(=CC=CC=C[C@H](C[C@H](C(=O)[C@@H]([C@@H](C(=C[C@H](C(=O)C1)C)C)O)OC)C)C)C)C
Complexity:
1810
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
15
DefinedBondStereocenterCount:
4
HeavyAtomCount:
68
HydrogenBondAcceptorCount:
14
HydrogenBondDonorCount:
3
RotatableBondCount:
9
Xlogp3:
5.9
CatalogNumber: AA80961
ChemicalName: (R)-2-Methoxymethoxy-1-propanol
CasNumber: 159350-97-7
MolecularFormula: C5H12O3
MolecularWeight: 120.147
MdlNumber: MFCD07367837
Smiles: C[C@@H](OCOC)CO
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AA80961
ChemicalName:
(R)-2-Methoxymethoxy-1-propanol
CasNumber:
159350-97-7
MolecularFormula:
C5H12O3
MolecularWeight:
120.147
MdlNumber:
MFCD07367837
Smiles:
C[C@@H](OCOC)CO
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCC1OC1C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCC1OC1C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCC[C@@H](C(=O)O[C@H]1C[C@H](O)C=C2[C@H]1[C@@H](CC[C@H](C[C@H](CC(=O)O)O)O)[C@H](C=C2)C)C
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCC[C@@H](C(=O)O[C@H]1C[C@H](O)C=C2[C@H]1[C@@H](CC[C@H](C[C@H](CC(=O)O)O)O)[C@H](C=C2)C)C
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__