116-59-6,MFCD00056384
Catalog No.:AA009QSN

116-59-6 | 4-PREGNENE-17-A-20-B-21-TRIOL-*3-11-DION E

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
3 weeks  
$553.00   $387.00
- +
500mg
3 weeks  
$3,049.00   $2,134.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009QSN
Chemical Name:
4-PREGNENE-17-A-20-B-21-TRIOL-*3-11-DION E
CAS Number:
116-59-6
Molecular Formula:
C21H30O5
Molecular Weight:
362.4599
MDL Number:
MFCD00056384
SMILES:
OC[C@H]([C@@]1(O)CC[C@@H]2[C@]1(C)CC(=O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)O
Properties
Computed Properties
 
Complexity:
684  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
7  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Literature

Title: Synthesis of 17,20beta,21-trihydroxypregn-4-en-3-one by ovaries of reproductively mature Atlantic cod Gadus morhua.

Journal: Journal of fish biology 20100701

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SDS
Tags:116-59-6 Molecular Formula|116-59-6 MDL|116-59-6 SMILES|116-59-6 4-PREGNENE-17-A-20-B-21-TRIOL-*3-11-DION E
Catalog No.: AA009QSN
116-59-6,MFCD00056384
116-59-6 | 4-PREGNENE-17-A-20-B-21-TRIOL-*3-11-DION E
Pack Size: 50mg
Purity:
3 weeks
$553.00 $387.00
Pack Size: 500mg
Purity:
3 weeks
$3,049.00 $2,134.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA009QSN
Chemical Name: 4-PREGNENE-17-A-20-B-21-TRIOL-*3-11-DION E
CAS Number: 116-59-6
Molecular Formula: C21H30O5
Molecular Weight: 362.4599
MDL Number: MFCD00056384
SMILES: OC[C@H]([C@@]1(O)CC[C@@H]2[C@]1(C)CC(=O)[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)O
Properties
Complexity: 684  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 7  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 26  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Literature fold

Title: Synthesis of 17,20beta,21-trihydroxypregn-4-en-3-one by ovaries of reproductively mature Atlantic cod Gadus morhua.

Journal: Journal of fish biology20100701

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