CS-0532773
(Z)-(1S,3R,7S,8S,8aR)-8-(2-((2R,4R)-4-Hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2-methylbut-2-enoate Lovastatin Impurity
Manufacturer: ChemScene
CAS Number: 1048973-04-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₄H₃₄O₅
Molecular Weight
402.52
Synonyms
(1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-diMethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl Ester (2Z)-2-Methyl-2-butenoic Acid
SMILES
C/C=C(C)\C(O[C@@H]1[C@@]2([H])C(C=C[C@@H]([C@@H]2CC[C@@H]3C[C@H](CC(O3)=O)O)C)=C[C@@H](C1)C)=O
Tpsa
72.83
Logp
4.1156
H Acceptors
5
H Donors
1
Rotatable Bonds
5
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₄O₅
Molecular Weight: 402.52
Synonyms: (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-diMethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl Ester (2Z)-2-Methyl-2-butenoic Acid
SMILES: C/C=C(C)\C(O[C@@H]1[C@@]2([H])C(C=C[C@@H]([C@@H]2CC[C@@H]3C[C@H](CC(O3)=O)O)C)=C[C@@H](C1)C)=O
Tpsa: 72.83
Logp: 4.1156
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₄O₅
Molecular Weight:
402.52
Synonyms:
(1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-diMethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl Ester (2Z)-2-Methyl-2-butenoic Acid
SMILES:
C/C=C(C)\C(O[C@@H]1[C@@]2([H])C(C=C[C@@H]([C@@H]2CC[C@@H]3C[C@H](CC(O3)=O)O)C)=C[C@@H](C1)C)=O
Tpsa:
72.83
Logp:
4.1156
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₉NO₇
Molecular Weight: 419.47
Synonyms: O-Desmethyl mycophenolate mofetil
SMILES: OC(C(C/C=C(C)/CCC(OCCN1CCOCC1)=O)=C2O)=C(C3=O)C(CO3)=C2C
Tpsa: 105.53
Logp: 2.22102
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₉NO₇
Molecular Weight:
419.47
Synonyms:
O-Desmethyl mycophenolate mofetil
SMILES:
OC(C(C/C=C(C)/CCC(OCCN1CCOCC1)=O)=C2O)=C(C3=O)C(CO3)=C2C
Tpsa:
105.53
Logp:
2.22102
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₃₂ClN₂O₈PS
Molecular Weight: 502.95
Synonyms: Dehydro Clindamycin Phosphate
SMILES: O=C([C@@H]1C/C(CN1C)=C/CC)N[C@@H]([C@@]2([H])O[C@@H]([C@@H]([C@H]([C@H]2O)O)OP(O)(O)=O)SC)[C@@H](Cl)C
Tpsa: 148.79
Logp: 0.4266
H Acceptors: 8
H Donors: 5
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₃₂ClN₂O₈PS
Molecular Weight:
502.95
Synonyms:
Dehydro Clindamycin Phosphate
SMILES:
O=C([C@@H]1C/C(CN1C)=C/CC)N[C@@H]([C@@]2([H])O[C@@H]([C@@H]([C@H]([C@H]2O)O)OP(O)(O)=O)SC)[C@@H](Cl)C
Tpsa:
148.79
Logp:
0.4266
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₃₄N₂O₂
Molecular Weight: 442.59
Synonyms: 4-(4-Hydroxy-4-phenylpiperidin-1-yl)-N,N-dimethyl-2,2-diphenylbutanamide
SMILES: O=C(C(C1=CC=CC=C1)(CCN2CCC(C3=CC=CC=C3)(CC2)O)C4=CC=CC=C4)N(C)C
Tpsa: 43.78
Logp: 4.4346
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₃₄N₂O₂
Molecular Weight:
442.59
Synonyms:
4-(4-Hydroxy-4-phenylpiperidin-1-yl)-N,N-dimethyl-2,2-diphenylbutanamide
SMILES:
O=C(C(C1=CC=CC=C1)(CCN2CCC(C3=CC=CC=C3)(CC2)O)C4=CC=CC=C4)N(C)C
Tpsa:
43.78
Logp:
4.4346
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
7