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Sparteine sulfate

CAT: 0607-N2257-20Size: 20 mgDry Ice: NoHazardous: No
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CAT#:0607-N2257-20Size:20 mg
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CAS Number
299-39-8
Field of Research
Natural Products
Purity
0.98
Smiles
C1CCN2CC3CC(C2C1)CN4C3CCCC4.OS(=O)(=O)O
Molecular Formula
C15H28N2O4S
Molecular Weight
332.46
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

7,14-Methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocine, dodecahydro-, (7S,7aR,14S,14aS)-, sulfate (1:1)

See also: Sparteine Sulfate (annotation moved to).

CAS Number299-39-8
PubChem CID23616742
IUPAC Name(1S,2R,9S,10S)-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecane;sulfuric acid
Molecular FormulaC15H28N2O4S
Molecular Weight332.5
Topological Polar Surface Area89.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count22
Formal Charge0
Complexity344
SMILES
C1CCN2C[C@@H]3C[C@H]([C@H]2C1)CN4[C@H]3CCCC4.OS(=O)(=O)O
InChI
InChI=1S/C15H26N2.H2O4S/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17;1-5(2,3)4/h12-15H,1-11H2;(H2,1,2,3,4)/t12-,13-,14-,15+;/m0./s1
InChIKey
FCEHFCFHANDXMB-UMEYXWOPSA-N
Chemical Structure
2D Structure
2D structure of 7,14-Methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocine, dodecahydro-, (7S,7aR,14S,14aS)-, sulfate (1:1)
CAS: 299-39-8
CID: 23616742
Formula: C15H28N2O4S
MW: 332.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass332.17697855
Monoisotopic Mass332.17697855
Topological Polar Surface Area89.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity344
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-S679500-2.5GSparteine Sulfate
HY-N0491-01(-) -Sparteine (sulfate)
C11134(-) -Sparteine Sulfate
HY-B1304-01(-) -Sparteine (sulfate pentahydrate)
M15325-01(-) -Sparteine sulfate pentahydrate
MBS576677(-)-Sparteine sulfate pentahydrate
HY-B1304A(+) -Sparteine (sulfate pentahydrate)
T62265-01(+) -Sparteine sulfate pentahydrate
MBS5804953(+)-Sparteine sulfate pentahydrate
GTR19153800-01Sparteine sulfate pentahydrate

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