CS-0650952
Methyl (2R,3R,3aS,4aS,5S,6S,7S,8aS,9aR)-2-(6-amino-9H-purin-9-yl)-4a,5,6-trihydroxy-3-methoxydecahydrofuro[3,2-b]pyrano[2,3-e]pyran-7-carboxylate
Manufacturer: ChemScene
CAS Number: 252062-10-5
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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
C₁₈H₂₃N₅O₉
Molecular Weight
453.40
Synonyms
None
SMILES
CO[C@@H]1[C@]2([H])[C@](C[C@@]3([H])[C@@](O2)([C@H]([C@@H]([C@H](O3)C(OC)=O)O)O)O)([H])O[C@H]1N4C5=NC=NC(N)=C5N=C4
Tpsa
193.53
Logp
-2.5394
H Acceptors
14
H Donors
4
Rotatable Bonds
3
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SAFETY INFORMATION
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: C₁₈H₂₃N₅O₉
Molecular Weight: 453.40
Synonyms: None
SMILES: CO[C@@H]1[C@]2([H])[C@](C[C@@]3([H])[C@@](O2)([C@H]([C@@H]([C@H](O3)C(OC)=O)O)O)O)([H])O[C@H]1N4C5=NC=NC(N)=C5N=C4
Tpsa: 193.53
Logp: -2.5394
H Acceptors: 14
H Donors: 4
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:
C₁₈H₂₃N₅O₉
Molecular Weight:
453.40
Synonyms:
None
SMILES:
CO[C@@H]1[C@]2([H])[C@](C[C@@]3([H])[C@@](O2)([C@H]([C@@H]([C@H](O3)C(OC)=O)O)O)O)([H])O[C@H]1N4C5=NC=NC(N)=C5N=C4
Tpsa:
193.53
Logp:
-2.5394
H Acceptors:
14
H Donors:
4
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₄O₃Si
Molecular Weight: 292.45
Synonyms: None
SMILES: C[Si](OC(C)(C)C#C)(OC(C)(C)C#C)OC(C)(C)C#C
Tpsa: 27.69
Logp: 2.8403
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 6
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₄O₃Si
Molecular Weight:
292.45
Synonyms:
None
SMILES:
C[Si](OC(C)(C)C#C)(OC(C)(C)C#C)OC(C)(C)C#C
Tpsa:
27.69
Logp:
2.8403
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₆N₂O
Molecular Weight: 110.11
Synonyms: None
SMILES: C12=NOC=C1CNC2
Tpsa: 38.06
Logp: 0.2778
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₆N₂O
Molecular Weight:
110.11
Synonyms:
None
SMILES:
C12=NOC=C1CNC2
Tpsa:
38.06
Logp:
0.2778
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₅NO
Molecular Weight: 117.19
Synonyms: None
SMILES: C[C@@H](NC(C)C)CO
Tpsa: 32.26
Logp: 0.3652
H Acceptors: 2
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:
C₆H₁₅NO
Molecular Weight:
117.19
Synonyms:
None
SMILES:
C[C@@H](NC(C)C)CO
Tpsa:
32.26
Logp:
0.3652
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
3