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163018-26-6,MFCD22572728
Catalog No.:AA001TJN

163018-26-6 | 3-O-(2-Aminoethyl)-25-hydroxyvitamin D3

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$149.00   $104.00
- +
5mg
≥98%
in stock  
$619.00   $433.00
- +
10mg
≥98%
in stock  
$1,152.00   $806.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001TJN
Chemical Name:
3-O-(2-Aminoethyl)-25-hydroxyvitamin D3
CAS Number:
163018-26-6
Molecular Formula:
C30H51NO2
Molecular Weight:
457.7314
MDL Number:
MFCD22572728
SMILES:
NCCCO[C@H]1CCC(=C)/C(=C\C=C\2/CCC[C@]3([C@H]2CC[C@@H]3[C@@H](CCCC(O)(C)C)C)C)/C1
Properties
Computed Properties
 
Complexity:
721  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
2  
Formal Charge:
0  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
10  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
6.1  

Downstream Synthesis Route
88574-06-5    163018-26-6   
25-hydroxyvitaminD3-3β-3'-<6-N-(fluorenylmethyl-O-carboxy)hexamido>aminopropylether 

[1]Steroids,1995,vol.60,p.600-603

163018-26-6   
25-hydroxyvitaminD3-3β-3'-(6-aminohexanoyl)aminopropylether 

[1]Steroids,1995,vol.60,p.600-603

3-(((S,Z)-3-((E)-2-((1R,3aS,7aR)-1-((R)-6-hydroxy-6-methylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexyl)oxy)propanenitrile 
  163018-26-6 

[1]Patent:EP1097132,2003,B1.Locationinpatent:Page8;9;21

[2]Patent:US2016/114049,2016,A1.Locationinpatent:Paragraph0178

[3]Patent:US2016/114001,2016,A1.Locationinpatent:Paragraph0181

[4]Patent:US2016/113993,2016,A1.Locationinpatent:Paragraph0237

[1]Patent:EP1097132,2003,B1.Locationinpatent:Page9;21

C58H109NO31 
  163018-26-6   
C84H155NO30 

[1]Patent:US2016/114049,2016,A1.Locationinpatent:Paragraph0184

[2]Patent:US2016/114001,2016,A1.Locationinpatent:Paragraph0187

[3]Patent:US2016/113993,2016,A1.Locationinpatent:Paragraph0243

Literature

Title: Roy A, et al. Aminopropylation of vitamin D hormone (1α,25-dihydroxyvitamin D3), its biological precursors, and other steroidal alcohols: an anchoring moiety for affinity studies of sterols. Steroids (1995), 60(8), 530-3.

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SDS
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Tags:163018-26-6 Molecular Formula|163018-26-6 MDL|163018-26-6 SMILES|163018-26-6 3-O-(2-Aminoethyl)-25-hydroxyvitamin D3
Catalog No.: AA001TJN
163018-26-6,MFCD22572728
163018-26-6 | 3-O-(2-Aminoethyl)-25-hydroxyvitamin D3
Pack Size： 1mg
Purity： ≥98%
in stock
$149.00 $104.00
Pack Size： 5mg
Purity： ≥98%
in stock
$619.00 $433.00
Pack Size： 10mg
Purity： ≥98%
in stock
$1,152.00 $806.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001TJN
Chemical Name: 3-O-(2-Aminoethyl)-25-hydroxyvitamin D3
CAS Number: 163018-26-6
Molecular Formula: C30H51NO2
Molecular Weight: 457.7314
MDL Number: MFCD22572728
SMILES: NCCCO[C@H]1CCC(=C)/C(=C\C=C\2/CCC[C@]3([C@H]2CC[C@@H]3[C@@H](CCCC(O)(C)C)C)C)/C1
Properties
Complexity: 721  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 5  
Defined Bond Stereocenter Count: 2  
Formal Charge: 0  
Heavy Atom Count: 33  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 10  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 6.1  
Downstream Synthesis Route
88574-06-5    163018-26-6   
25-hydroxyvitaminD3-3β-3'-<6-N-(fluorenylmethyl-O-carboxy)hexamido>aminopropylether 

[1]Steroids,1995,vol.60,p.600-603

163018-26-6   
25-hydroxyvitaminD3-3β-3'-(6-aminohexanoyl)aminopropylether 

[1]Steroids,1995,vol.60,p.600-603

3-(((S,Z)-3-((E)-2-((1R,3aS,7aR)-1-((R)-6-hydroxy-6-methylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexyl)oxy)propanenitrile 
  163018-26-6 

[1]Patent:EP1097132,2003,B1.Locationinpatent:Page8;9;21

[2]Patent:US2016/114049,2016,A1.Locationinpatent:Paragraph0178

[3]Patent:US2016/114001,2016,A1.Locationinpatent:Paragraph0181

[4]Patent:US2016/113993,2016,A1.Locationinpatent:Paragraph0237

89889-52-1    163018-26-6    193278-61-4 

[1]Patent:EP1097132,2003,B1.Locationinpatent:Page9;21

C58H109NO31 
  163018-26-6   
C84H155NO30 

[1]Patent:US2016/114049,2016,A1.Locationinpatent:Paragraph0184

[2]Patent:US2016/114001,2016,A1.Locationinpatent:Paragraph0187

[3]Patent:US2016/113993,2016,A1.Locationinpatent:Paragraph0243

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