CS-0531789
(2aS,3S,4R,6aS,6bS,7R,8aR,11aS,12aS,12bS)-4,7-Dihydroxy-3,6a,12a,12b-tetramethyl-9-(4-methylpent-3-en-1-yl)-2a,3,4,5,6,6a,6b,7,8,8a,11a,12,12a,12b-tetradecahydro-1H-naphtho[2',1':4,5]indeno[2,1-b]furan-10(2H)-one Sodium Fusidate Impurity
Manufacturer: ChemScene
CAS Number: 4701-54-6
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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
C₂₉H₄₄O₄
Molecular Weight
456.66
Synonyms
16-Deacetylfusidic Acid gamma-Lactone
SMILES
C[C@@]12[C@]([C@@H](C[C@]3([H])[C@@]2(C[C@@]4([H])C3=C(C(O4)=O)CC/C=C(C)/C)C)O)([H])[C@@]5([C@@]([C@@H]([C@@H](CC5)O)C)([H])CC1)C
Tpsa
66.76
Logp
5.5752
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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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: C₂₉H₄₄O₄
Molecular Weight: 456.66
Synonyms: 16-Deacetylfusidic Acid gamma-Lactone
SMILES: C[C@@]12[C@]([C@@H](C[C@]3([H])[C@@]2(C[C@@]4([H])C3=C(C(O4)=O)CC/C=C(C)/C)C)O)([H])[C@@]5([C@@]([C@@H]([C@@H](CC5)O)C)([H])CC1)C
Tpsa: 66.76
Logp: 5.5752
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₄₄O₄
Molecular Weight:
456.66
Synonyms:
16-Deacetylfusidic Acid gamma-Lactone
SMILES:
C[C@@]12[C@]([C@@H](C[C@]3([H])[C@@]2(C[C@@]4([H])C3=C(C(O4)=O)CC/C=C(C)/C)C)O)([H])[C@@]5([C@@]([C@@H]([C@@H](CC5)O)C)([H])CC1)C
Tpsa:
66.76
Logp:
5.5752
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₄FN₅O₁₀P₂
Molecular Weight: 445.19
Synonyms: 9-(3,5-Di-O-phosphono-beta-D-arabinofuranosyl)-2-fluoro-9H-purin-6-amine
SMILES: NC1=C2C(N([C@@]3([H])[C@H]([C@@H]([C@H](O3)COP(O)(O)=O)OP(O)(O)=O)O)C=N2)=NC(F)=N1
Tpsa: 232.6
Logp: -1.6069
H Acceptors: 11
H Donors: 6
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₄FN₅O₁₀P₂
Molecular Weight:
445.19
Synonyms:
9-(3,5-Di-O-phosphono-beta-D-arabinofuranosyl)-2-fluoro-9H-purin-6-amine
SMILES:
NC1=C2C(N([C@@]3([H])[C@H]([C@@H]([C@H](O3)COP(O)(O)=O)OP(O)(O)=O)O)C=N2)=NC(F)=N1
Tpsa:
232.6
Logp:
-1.6069
H Acceptors:
11
H Donors:
6
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₅N₆O₇P
Molecular Weight: 362.24
Synonyms: 5'-Adenylic acid, 2-amino-
SMILES: NC1=C2C(N([C@]3([H])O[C@@H]([C@H]([C@H]3O)O)COP(O)(O)=O)C=N2)=NC(N)=N1
Tpsa: 212.09
Logp: -2.2808
H Acceptors: 11
H Donors: 6
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₅N₆O₇P
Molecular Weight:
362.24
Synonyms:
5'-Adenylic acid, 2-amino-
SMILES:
NC1=C2C(N([C@]3([H])O[C@@H]([C@H]([C@H]3O)O)COP(O)(O)=O)C=N2)=NC(N)=N1
Tpsa:
212.09
Logp:
-2.2808
H Acceptors:
11
H Donors:
6
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₈N₂O₂
Molecular Weight: 352.47
Synonyms: 1-Ethyl-4-(2-((2-hydroxyethyl)amino)ethyl)-3,3-diphenylpyrrolidin-2-one
SMILES: O=C1N(CC(C1(C2=CC=CC=C2)C3=CC=CC=C3)CCNCCO)CC
Tpsa: 52.57
Logp: 2.423
H Acceptors: 3
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:
C₂₂H₂₈N₂O₂
Molecular Weight:
352.47
Synonyms:
1-Ethyl-4-(2-((2-hydroxyethyl)amino)ethyl)-3,3-diphenylpyrrolidin-2-one
SMILES:
O=C1N(CC(C1(C2=CC=CC=C2)C3=CC=CC=C3)CCNCCO)CC
Tpsa:
52.57
Logp:
2.423
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
8