Home Other Building Blocks 17a-Acetoxy-6-methyl-16-methylene-4,6-pregnadiene-3,20-dione

17a-Acetoxy-6-methyl-16-methylene-4,6-pregnadiene-3,20-dione

CAS No.:
2919-66-6
Catalog Number:
AG00354P
Molecular Formula:
C25H32O4
Molecular Weight:
396.5192
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
98%(HPLC)
In Stock USA
United States
$87
- +
100mg
98%(HPLC)
In Stock USA
United States
$147
- +
500mg
98%(HPLC)
In Stock USA
United States
$519
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1g
98%(HPLC)
In Stock USA
United States
$921
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Product Description
Catalog Number:
AG00354P
Chemical Name:
17a-Acetoxy-6-methyl-16-methylene-4,6-pregnadiene-3,20-dione
CAS Number:
2919-66-6
Molecular Formula:
C25H32O4
Molecular Weight:
396.5192
MDL Number:
MFCD00072142
IUPAC Name:
[(8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-16-methylidene-3-oxo-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate
InChI:
InChI=1S/C25H32O4/c1-14-11-19-20(23(5)9-7-18(28)13-21(14)23)8-10-24(6)22(19)12-15(2)25(24,16(3)26)29-17(4)27/h11,13,19-20,22H,2,7-10,12H2,1,3-6H3/t19-,20+,22+,23-,24+,25+/m1/s1
InChI Key:
UDKABVSQKJNZBH-DWNQPYOZSA-N
SMILES:
O=C1CC[C@]2(C(=C1)C(=C[C@@H]1[C@@H]2CC[C@]2([C@H]1CC(=C)[C@]2(OC(=O)C)C(=O)C)C)C)C
EC Number:
220-859-7
UNII:
4W5HDS3936
NSC Number:
70968
Properties
Complexity:
893  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
6  
Defined Bond Stereocenter Count:
0
Exact Mass:
396.23g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.527g/mol
Monoisotopic Mass:
396.23g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
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Properties